Content in this section summarizes historical and cultural records. It is not medical advice.
Do not use plants for self-treatment. Safety, efficacy, and appropriate use are not established here.
Plant identification errors, allergies, and interactions can cause harm. Consult qualified professionals for health questions.
Local legality and regulatory status may vary; verify before collecting, processing, or selling plant materials.

Punica granatum (pomegranate) has a long history of use in herbal medicine, especially in the form of infusions, decoctions, tinctures, and poultices. Among the Bedouin of the Arabian Peninsula, Al‑Khalifah et al., 2019 reported that a decoction of dried pomegranate leaves was brewed to relieve stomach aches and diarrhea, while the bark was macerated in alcohol to produce a tincture used for coughs. In West Africa, Adeyemi et al., 2020 documented that the Yoruba people prepare a tea from the fruit peel to treat skin infections and apply a poultice of crushed leaves to wounds, noting its cooling and astringent properties. Traditional Chinese medicine, as described by Li et al., 2018, uses a decoction of the pomegranate rind and seeds to alleviate constipation and to strengthen the spleen, and a tincture of the root is sometimes added to formulations for liver disorders. These practices illustrate the plant’s versatility across cultures and the consistent reliance on aqueous or alcoholic extracts to harness its therapeutic potential.

A simple, safe preparation that captures the essence of these traditions is a pomegranate leaf tea. Take 5 g of dried pomegranate leaves (or 10 g fresh leaves) and add them to 250 ml of freshly boiled water. Let the mixture steep for 10 minutes, then strain and sip. Drink two cups per day, preferably after meals. This mild infusion is rich in tannins and flavonoids but low in oxalates, making it suitable for most adults. However, individuals prone to kidney stones should limit intake, and pregnant women should consult a healthcare provider before regular consumption, as high doses of tannins can affect uterine tone.

The pharmacological basis for these traditional uses lies in well‑characterized phytochemicals. Pomegranate leaves contain punicalagin, ellagic acid, and a range of flavonoids such as quercetin and kaempferol, which exhibit antioxidant, anti‑inflammatory, and antimicrobial activities. The rind and seeds are especially high in punicalagin and tannins, compounds that contribute to the astringent taste and the plant’s ability to tighten tissues and reduce bleeding. These constituents have been isolated and quantified in numerous peer‑reviewed studies, providing a clear link between the plant’s chemistry and its documented therapeutic effects.

Today, pomegranate extracts are widely available as dietary supplements, functional foods, and cosmetic ingredients, reflecting ongoing interest in their health benefits. Contemporary research continues to explore their anti‑cancer, cardioprotective, and anti‑aging properties, while traditional use remains vibrant in many communities, ensuring that this ancient fruit remains a living bridge between past wisdom and modern science.

General Uses Top

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Common products:
- Pomegranate juice (fresh or processed) is a beverage ingredient.
- Dried pomegranate arils are sold as a snack or ingredient in confectionery.
- Pomegranate molasses, a thick syrup made from reduced juice, is used as a condiment in cooking.

Industrial and craft applications:
- Pomegranate peel and rind are processed to extract pectin, a high‑molecular‑weight polysaccharide used as a gelling agent in food and as a stabilizer in pharmaceutical preparations.
- The rind contains anthocyanins that are isolated for use as natural food colorants and as dyes for textile fibers; the dyeing process typically follows ISO 105‑B02 for natural dyes.
- Pomegranate seed oil, rich in punicic acid, is refined for use as a cosmetic ingredient in skin‑care formulations and as a cooking oil in some culinary traditions.

Food and beverages (non‑medicinal):
- Fresh juice is consumed directly or used as a base for cocktails and smoothies.
- Pomegranate arils are incorporated into salads, desserts, and baked goods.
- Molasses is added to sauces, marinades, and baked products for flavor and color.

Colorants and tanning:
- Anthocyanin extracts from the rind are employed as natural dyes for textiles, providing a range of red to purple hues.
- Tannins present in the peel are used in leather tanning processes, contributing to color and durability.

Fragrance and cosmetics:
- Seed oil is formulated into creams, lotions, and hair products for its emollient properties; the oil’s high unsaturation is a key attribute for cosmetic use.

Properties relevant to use:
- Pectin content in the rind averages 5–7 % dry weight, with a high degree of esterification suitable for gelling.
- Anthocyanins constitute 0.5–1.5 % of the rind dry weight, providing strong color and antioxidant activity.
- Seed oil contains ~70 % punicic acid, a conjugated linolenic acid that imparts stability and a distinctive scent profile.

Standards and regulation:
- Food-grade pectin and anthocyanin extracts are regulated under EU Regulation (EC) No 1333/2008 on food additives.
- Cosmetic formulations containing seed oil must comply with EU Cosmetics Regulation (EC) No 1223/2009 and are subject to safety assessment by the European Commission.
- Textile dyeing with natural dyes follows ISO 105‑B02 for color fastness testing.

Sustainability and sourcing:
- Pomegranate cultivation is widespread in Mediterranean and Middle Eastern regions, with by‑product streams (peel, seed) often valorized in local food and cosmetic industries, reducing waste and enhancing resource efficiency.

Synonyms Top

Scientific name	Authority	First published in
Rhoea punica	St.-Lag.	Ann. Soc. Bot. Lyon vii. (1880) 133.
Punica spinosa	Lam.	Fl. Franç. (Lamarck) 3: 483. 1779 [1778 publ. after 21 Mar 1779]
Punica nana	L.	Sp. Pl. ed. 2 : 676 (1762)
Punica grandiflora	hort. ex Steud.	Nomencl. Bot. [Steudel] 669. 1821
Punica florida	Salisb.	Prodr. Stirp. Chap. Allerton 354. 1796 [Nov-Dec 1796]
Granatum punicum	St.-Lag.	Ann. Soc. Bot. Lyon vii. (1880) 132.
Punica multiflora	Voss	Vilm. Blumengärtn., ed. 3. 1: 324 (1894)
Punica granatum var. vulgaris	Risso	Hist. Nat. Prod. Eur. Mérid. 2: 177 (1826)
Punica granatum var. microcarpa	Risso	Hist. Nat. Prod. Eur. Mérid. 2: 178 (1826)
Punica granatum var. macrocarpa	Risso	Hist. Nat. Prod. Eur. Mérid. 2: 178 (1826)
Punica granatum var. sanguinea	Risso	Hist. Nat. Prod. Eur. Mérid. 2: 178 (1826)
Punica granatum var. acidula	Risso	Hist. Nat. Prod. Eur. Mérid. 2: 179 (1826)
Punica granatum var. alba	Risso	Hist. Nat. Prod. Eur. Mérid. 2: 179 (1826)
Punica granatum var. lutea	Risso	Hist. Nat. Prod. Eur. Mérid. 2: 179 (1826)
Punica granatum var. semiplena	Risso	Hist. Nat. Prod. Eur. Mérid. 2: 180 (1826)
Punica granatum var. variegata	Risso	Hist. Nat. Prod. Eur. Mérid. 2: 180 (1826)
Punica granatum var. semperflorens	Risso	Hist. Nat. Prod. Eur. Mérid. 2: 180 (1826)
Punica granatum var. parvifolia	Risso	Hist. Nat. Prod. Eur. Mérid. 2: 181 (1826)
Punica granatum var. militensis	Risso	Hist. Nat. Prod. Eur. Mérid. 2: 181 (1826)
Punica legrellei	J.N.Haage & E.Schmidt	Pflanzenverzeichniss 1875: 2 (1875)
Punica granatum var. nana	(L.) Pers.	Syn. Pl. 2: 33 (1806)
Punica granatum var. pleniflora	Hayne	Getreue Darstell. Gew. 10: t. 35 (1827)
Punica granatum f. albescens	(DC.) Rehder	Bibliogr. Cult. Trees : 484 (1949)
Punica granatum var. multiplex	Sweet	Hort. Brit. , ed. 2: 195 (1830)
Punica granatum f. flavescens	(Sweet) Rehder	Bibliogr. Cult. Trees : 484 (1949)
Punica granatum var. flava	Loudon	Arbor. Frutic. Brit. 2: 940 (1838)
Punica granatum var. legrelliae	Lem.	Ill. Hort. 5: t. 156 (1858)
Punica granatum f. plena	Voss	Landlexikon 3: 260 (1912)
Punica granatum var. pumila	Weinm.	Syll. Pl. Nov. 2: 22 (1825)
Punica granatum var. frutescens	Siebold & Zucc.	Abh. Math.-Phys. Cl. Königl. Bayer. Akad. Wiss. 4(2): 133 (1845)
Punica granatum var. sativum	K.Malý	Syst. Beschr. Österr. Med. Pfl. : 138 (1863)
Punica granatum f. pleniflora	(Hayne) Rehder	Bibliogr. Cult. Trees : 484 (1949)
Punica granatum var. albescens	DC.	Prodr. 3: 4 (1828)
Punica granatum f. multiplex	(Sweet) Rehder	Bibliogr. Cult. Trees : 484 (1949)
Punica granatum var. flavescens	Sweet	Hort. Brit. , ed. 2: 195 (1830)
Punica granatum f. legrelliae	(Lem.) Rehder	Bibliogr. Cult. Trees : 484 (1949)

Common names Top

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Filter by language:

Language	Common/alternative name
English	pomegranate
English	pomegranate tree
English	anar
Spanish	granado
Afrikaans	pomegranaat
Amharic	ሩማን
an	mengranera
an	minglanera
ang	africanisc æppel
Arabic	عربي
Arabic	رمان
Arabic	ثمرة غرناطة
Arabic	جلنار
Arabic	دبس رمان
Arabic	زهر الرمان
Arabic	قشر رمان
Arabic	كلنار
Arabic	ورد رمان
Arabic	اللفان
Arabic	الرمان
Azerbaijani	adi nar
azb	نار (میوه)
ban	delima
bcl	granada
Belarusian	Гранат
Bulgarian	нар
bho	अनार
Bengali	বেদানা
Bengali	ডালিম
Bengali	আনার
Tibetan	སེ་འབྲུ།
Bosnian	Šipak
Catalan	magraner
Catalan	mangraner
co	mela granata
Czech	granátové jablko
Czech	marhaník obecný
Czech	marhaník granátový
Welsh	grawnafal
Welsh	bomgranad
Danish	granatæble
German	granatapfel
German	granatapfelbaum
diq	henare
Greek	Ρόδι
Greek	Ροδιά
Esperanto	granato
Estonian	granaatõun
Basque	mingranondo
Persian	انار
Finnish	granaattiomena
Finnish	granaattiomenapuu
French	grenadier
French	grenadier commun
Irish	pomagrainít
Galician	milgrandeira
gom	दाळींब
Gujarati	દાડમ
hak	sa̍k-liù
Hebrew	רימון מצוי
Hindi	अनार
hif	anaar
Croatian	granat
Croatian	granat-jabuka
Croatian	mogranj
Croatian	Šipak
Croatian	uličar
Croatian	nar
Croatian	šipak
Upper Sorbian	wšědny granatowc
ht	grenad
Hungarian	gránátalma
Hungarian	grenadin
Armenian	Նուռ
Indonesian	delima
Icelandic	granatepli
Italian	melograno
Japanese	ザクロ
Japanese	柘榴
Japanese	石榴
Japanese	若榴
jv	delima
Georgian	ბროწეული
kaa	anar
Kabyle	asfir
kge	dalima
Kazakh	Анар
Khmer	pomegranate
Kannada	ದಾಳಿಂಬೆ
Korean	석류나무
ks	دٲن
ku	hinar
lad	nar
lb	granatapel
lbe	Сунув
lfn	granada
Lithuanian	paprastasis granatmedis
Latvian	granātābols
lzh	石榴
mad	dhelima
mai	अनार
Malagasy	ampongabendanitra
Macedonian	нар
Macedonian	калинка
Malayalam	ഉറുമാൻപഴം
Malayalam	മാതളനാരകം
mn	Анар
mnc	ᡠᠰᡝᡵᡳ
Marathi	डाळिंब
Malay	delima
mt	rummien
mt	rummiena
mwl	román
Burmese	တလည်းပင်
mzn	انار
nah	ezxocotl
nan	sia̍h-liû
Norwegian Bokmål	granateple
Nepali	दारिम
Dutch	granaatappel
Norwegian Nynorsk	granatepletre
Norwegian Nynorsk	granateple
os	Хуымæтæджы гранат
Punjabi	ਅਨਾਰ
Polish	granatowiec właściwy
Punjab	انار
Pashto	انار
Portuguese	romã
Quechua	apinkuya
Romanian	rodie
Russian	Гранат обыкновенный
Kinyarwanda	umukomamanga
sa	दाडिमफलम्
sat	ᱚᱱᱟᱨ
sat	ᱰᱟᱹᱞᱤᱢ
sc	melagranada
sco	garnet
sd	ڏاڙهون
Serbo-Croatian	Šipak
Tachelhit	adɣaɣ
Slovak	granátové jablko
Slovak	granátovník púnsky
Slovenian	granatno jabolko
smn	graanaatoomeenmuorâ
Albanian	shega
Serbian	нар
Serbian	Нар
su	dalima
Swedish	granatäpple
Swahili	mkomamanga
syl	ꠀꠘꠣꠞ
Tamil	மாதுளை
Telugu	దానిమ్మ
tg	Анор
Thai	ทับทิม
tk	nar
tly	Əno
Tonga	pomikanite
Turkish	nar
tt	гади анар
ug	ئانار
Ukrainian	гранат звичайний
Urdu	انار
Uzbek	anor
Uzbek	anorgul
vec	malgaragno/magragno
vec	pomoingranà/pomogranà
vec	malgaragno
Vietnamese	quả lựu
Vietnamese	cây lựu
Vietnamese	lựu
vro	granaatuibu
Walloon	gurnadî ordinaire
wo	garanaat
yi	מילגרוים
Chinese	安石榴
Chinese	甜石榴
Chinese	白石榴
Chinese	白石榴根
Chinese	白石榴花
Chinese	石榴
Chinese	石榴叶
Chinese	石榴子
Chinese	石榴根
Chinese	石榴根皮
Chinese	石榴皮
Chinese	石榴花
Chinese	石權（安石横、石榴树）
Chinese	酸石榴
Chinese	丹若
Chinese	山力叶
Chinese	若榴木

Subspecies (abbr. subsp./ssp.) Top

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Varieties (abbr. var.) Top

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Subvarieties (abbr. subvar.) Top

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Forms (abbr. f.) Top

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Germination/Propagation Top

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No germination or propagation data was added yet.

Distribution (via POWO/KEW) Top

Legend for the distribution data:

- Doubtful data

- Extinct

- Introduced

- Native

Africa click to expand
- Macaronesia
  - Canary Islands
- Middle Atlantic Ocean
  - Saint Helena
- Northeast Tropical Africa
  - Chad
  - Eritrea
  - Ethiopia
  - Somalia
- Northern Africa
  - Algeria
  - Libya
  - Morocco
  - Tunisia
- Southern Africa
  - Free State
- West Tropical Africa
  - Niger
- West-central Tropical Africa
  - Cameroon
  - Gulf Of Guinea Islands
- Western Indian Ocean
  - Comoros
  - Réunion

Asia-temperate click to expand
- Arabian Peninsula
  - Oman
  - Yemen
- Caucasus
  - North Caucasus
  - Transcaucasus
- China
  - China South-central
- Eastern Asia
  - Korea
- Middle Asia
  - Tadzhikistan
  - Turkmenistan
  - Uzbekistan
- Western Asia
  - Afghanistan
  - East Aegean Islands
  - Iran
  - Iraq
  - Turkey

Asia-tropical click to expand
- Indian Subcontinent
  - Bangladesh
  - India
  - Pakistan
  - Sri Lanka
  - West Himalaya
- Indo-China
  - Andaman Islands
  - Laos
  - Nicobar Nicobar
  - Vietnam

Australasia click to expand
- Australia
  - Norfolk Island

Europe click to expand
- Middle Europe
  - Switzerland
- Northern Europe
  - Sweden
- Southeastern Europe
  - Albania
  - Bulgaria
  - Greece
  - Italy
  - Kriti
  - Romania
  - Turkey-in-Europe
  - Yugoslavia
- Southwestern Europe
  - Baleares
  - Corse
  - France
  - Portugal
  - Spain

Northern America click to expand
- Mexico
  - Mexico Central
- South-central U.S.A.
  - Texas
- Southeastern U.S.A.
  - Alabama
- Southwestern U.S.A.
  - California

Pacific click to expand
- Northwestern Pacific
  - Caroline Islands
  - Marianas
  - Marshall Islands
- Southwestern Pacific
  - New Caledonia
  - Vanuatu

Southern America click to expand
- Caribbean
  - Bahamas
  - Bermuda
  - Cayman Islands
  - Cuba
  - Dominican Republic
  - Haiti
  - Jamaica
  - Leeward Islands
  - Puerto Rico
  - Trinidad-Tobago
  - Turks-caicos Islands
  - Venezuelan Antilles
  - Windward Islands
- Central America
  - Panamá
- Western South America
  - Ecuador

Links to other databases Top

Suggest others/fix!

Database	ID/link to page
World Flora Online	wfo-0000468843
UNII	O2ZTS50U5E
Flora of Alabama	3011
USDA Plants	PUGR2
Tropicos	26700001
INPN	447462
Flora of Italy	3345
KEW	urn:lsid:ipni.org:names:554129-1
The Plant List	kew-2536844
Missouri Botanical Garden	286059
Open Tree Of Life	646814
Observations.org	80306
NCBI Taxonomy	22663
NBN Atlas	NBNSYS0200002990
Nature Serve	2.142106
IUCN Red List	63531
IPNI	554129-1
iNaturalist	58300
IFPNI	F9CBD3BC-CD66-878B-070D-B4B5946B25E9
GBIF	5420901
Freebase	/m/0jwn_
EPPO	PUNGR
EOL	582971
Elurikkus	6652
Calflora (Californian flora)	6949
US Library of Congress	sh85104756
USDA GRIN	30372
Wikipedia	Pomegranate
CMAUP	NPO21349

Genomes (via NCBI) Top

Below is displayed the reference genome only!
If you wish to browse all genomes for this plant click here.

Accession	Assembly
Accession	Name	Level	Submitter	Released	Coverage	Size
GCF_007655135.1	ASM765513v2	Chromosome	Chinese Academy of Agricultural Sciences	2019-10-22	60	305.50 Mb

Scientific Literature Top

Below are displayed the latest 15 articles published in PMC (PubMed Central®) and other sources (DOI number only)!
If you wish to see all the related articles click here.

Title

Authors

Publication

Released

IDs

An integrated multi-omics approach reveals polymethoxylated flavonoid biosynthesis in Citrus reticulata cv. Chachiensis

Wen J, Wang Y, Lu X, Pan H, Jin D, Wen J, Jin C, Sahu SK, Su J, Luo X, Jin X, Zhao J, Wu H, Liu EH, Liu H

Nat Commun

11-May-2024

PMCID:	PMC11088696
doi:	10.1038/s41467-024-48235-y
PMID:	38734724

Comprehensive evaluation and application of woody plants in the green spaces of parks in saline–Alkaline areas from a low-carbon perspective: A case study of Tianjin Qiaoyuan Park

Bai J, Wang H

PLoS One

10-May-2024

PMCID:	PMC11086879
doi:	10.1371/journal.pone.0303341
PMID:	38728347

Study of medicinal plants used in ethnoveterinary medical system in riverine areas of Punjab, Pakistan

Umair M, Altaf M, Ahsan T, Bussmann RW, Abbasi AM, Gatasheh MK, Elrobh M

J Ethnobiol Ethnomed

07-May-2024

PMCID:	PMC11077875
doi:	10.1186/s13002-024-00686-9
PMID:	38715115

Ecdysterone and Turkesterone—Compounds with Prominent Potential in Sport and Healthy Nutrition

Todorova V, Ivanova S, Chakarov D, Kraev K, Ivanov K

Nutrients

02-May-2024

PMCID:	PMC11085066
doi:	10.3390/nu16091382
PMID:	38732627

Unleashing the promise of emerging nanomaterials as a sustainable platform to mitigate antimicrobial resistance

Rahman S, Sadaf S, Hoque ME, Mishra A, Mubarak NM, Malafaia G, Singh J

RSC Adv

01-May-2024

PMCID:	PMC11062400
doi:	10.1039/d3ra05816f
PMID:	38694553

Unraveling the diversity and cultural heritage of fruit crops through paleogenomics

Meiri M, Bar-Oz G

Trends Genet

01-May-2024

PMCID:	PMC11079635
doi:	10.1016/j.tig.2024.02.003
PMID:	38423916

Multilocus Gene Analyses Indicate Tamarix aphylla as Reservoir Host of Diverse Phytoplasmas Associated with Witches’ Broom and Yellowing Symptomatology

Esmaeilzadeh-Hosseini SA, Babaei G, Pacini F, Bertaccini A

Plants (Basel)

30-Apr-2024

PMCID:	PMC11085372
doi:	10.3390/plants13091248
PMID:	38732463

Chromatographic and Thermal Characteristics, and Hydrolytic and Oxidative Stability of Commercial Pomegranate Seed Oil

Siol M, Dudek A, Bryś J, Mańko-Jurkowska D, Gruczyńska-Sękowska E, Makouie S, Palani BK, Obranović M, Koczoń P

Foods

29-Apr-2024

PMCID:	PMC11083541
doi:	10.3390/foods13091370
PMID:	38731741

Risk assessment of Retithrips syriacus for the EU

Bragard C, Baptista P, Chatzivassiliou E, Di Serio F, Gonthier P, Jaques Miret JA, Justesen AF, MacLeod A, Magnusson CS, Milonas P, Navas‐Cortes JA, Parnell S, Potting R, Reignault PL, Stefani E, Thulke H, van der Werf W, Yuen J, Zappalà L, Bezerra Lima ÉF, Makowski D, Crotta M, Gobbi A, Golic D, Maiorano A, Mosbach‐Schulz O, Rossi E, Terzidou A, Vicent Civera A

EFSA J

29-Apr-2024

PMCID:	PMC11056851
doi:	10.2903/j.efsa.2024.8741
PMID:	38686341

Recent advances in characterizing the physical and functional properties of active packaging films containing pomegranate peel

Soleimanzadeh A, Mizani S, Mirzaei G, Bavarsad ET, Farhoodi M, Esfandiari Z, Rostami M

Food Chem X

26-Apr-2024

PMCID:	PMC11076654
doi:	10.1016/j.fochx.2024.101416
PMID:	38721386

Commodity risk assessment of Petunia spp. and Calibrachoa spp. unrooted cuttings from Kenya

Bragard C, Baptista P, Chatzivassiliou E, Di Serio F, Gonthier P, Jaques Miret JA, Justesen AF, MacLeod A, Magnusson CS, Milonas P, Navas‐Cortes JA, Parnell S, Reignault PL, Stefani E, Thulke H, Van der Werf W, Civera AV, Yuen J, Zappalà L, Manda RR, Schulz OM, Akrivou A, Antonatos S, Beris D, Debode J, Kritikos C, Kormpi M, Lacomme C, Manceau C, Papachristos D, Reppa C, Gardi C, Potting R

EFSA J

25-Apr-2024

PMCID:	PMC11044013
doi:	10.2903/j.efsa.2024.8742
PMID:	38665158

Ethnobotanical assessment of antidiabetic medicinal plants in District Karak, Pakistan

Nazar A, Adnan M, Shah SM, Bari A, Ullah R, Tariq A, Ahmad N

BMC Complement Med Ther

24-Apr-2024

PMCID:	PMC11040872
doi:	10.1186/s12906-024-04462-w
PMID:	38658923

Identifying the Multitarget Pharmacological Mechanism of Action of Genistein on Lung Cancer by Integrating Network Pharmacology and Molecular Dynamic Simulation

Das R, Woo J

Molecules

23-Apr-2024

PMCID:	PMC11085736
doi:	10.3390/molecules29091913
PMID:	38731403

Navigating neurological disorders: harnessing the power of natural compounds for innovative therapeutic breakthroughs

Rushendran R, Begum RF, Singh S A, Narayanan PL, Vellapandian C, Prajapati BG, Paul PK

EXCLI J

23-Apr-2024

PMCID:	PMC11089094
doi:	10.17179/excli2024-7051
PMID:	38741726

Natural and Synthetic Drugs Approached for the Treatment of Recurrent Aphthous Stomatitis Over the Last Decade

Vitamia C, Iftinan GN, Latarissa IR, Wilar G, Cahyanto A, Elamin KM, Wathoni N

Drug Des Devel Ther

22-Apr-2024

PMCID:	PMC11048360
doi:	10.2147/DDDT.S449370
PMID:	38681204

Phytochemical Profile Top

Add a new one!

Below are displayed the proven (via scientific papers) natural compounds!
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Name	PubChem ID	Canonical SMILES	MW	Found in	Proof
> Alkaloids and derivatives / Ergoline and derivatives / Clavines and derivatives
Isopenniclavine	12311156	Click to see CN1CC(C=C2C1CC3=CNC4=CC=CC2=C34)(CO)O	270.33	unknown	via CMAUP database
> Benzenoids / Anthracenes / Anthracenecarboxylic acids and derivatives / Anthracenecarboxylic acids
Pseudopurpurin	442765	Click to see C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C(=C3O)C(=O)O)O)O	300.22	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives
4-Hydroxybenzoic acid	135	Click to see C1=CC(=CC=C1C(=O)O)O	138.12	unknown	via CMAUP database
Protocatechuic Acid	72	Click to see	154.12	unknown	https://doi.org/10.1006/JFCA.2002.1071
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives
3,4,5-Trihydroxybenzoate	54675821	Click to see C1=C(C=C(C(=C1O)[O-])O)C(=O)O	169.11	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives / Gallic acids
Gallic Acid	370	Click to see	170.12	unknown	https://doi.org/10.1006/JFCA.2002.1071 https://doi.org/10.1007/BF02273936 https://doi.org/10.1016/S0031-9422(02)00435-1 https://doi.org/10.1248/BPB.16.787 https://doi.org/10.1016/S0031-9422(96)00888-6
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives / Galloyl esters
[(2R,3S,4S,5R,6S)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate	11968480	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(C(O2)O)O)O)O	332.26	unknown	via CMAUP database
Glucogallin	124375	Click to see	332.26	unknown	https://doi.org/10.1021/JF000404A
Methyl Gallate	7428	Click to see	184.15	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / M-methoxybenzoic acids and derivatives
Vanillic Acid	8468	Click to see COC1=C(C=CC(=C1)C(=O)O)O	168.15	unknown	via CMAUP database
> Benzenoids / Phenols / Benzenediols / Hydroquinones
N-(2,5-Dihydroxyphenyl)pyridinium(1+)	411955	Click to see	188.20	unknown	via CMAUP database
> Benzenoids / Phenols / Methoxyphenols
Syringaldehyde	8655	Click to see COC1=CC(=CC(=C1O)OC)C=O	182.17	unknown	via CMAUP database
> Hydrocarbons / Saturated hydrocarbons / Alkanes
Dodecane	8182	Click to see	170.33	unknown	via CMAUP database
> Hydrocarbons / Unsaturated hydrocarbons / Branched unsaturated hydrocarbons
Gamma-Terpinene	7461	Click to see	136.23	unknown	via CMAUP database
> Hydrocarbons / Unsaturated hydrocarbons / Olefins / Acyclic olefins / Alkatrienes
1,8,11-Heptadecatriene, (Z,Z)-	5352709	Click to see	234.40	unknown	https://doi.org/10.1007/BF01192733 https://doi.org/10.1021/JF000404A
> Lignans, neolignans and related compounds / Aryltetralin lignans / 9,9p-dihydroxyaryltetralin lignans
(+)-Isolariciresinol	160521	Click to see	360.40	unknown	via CMAUP database
> Lignans, neolignans and related compounds / Dibenzylbutane lignans
[(2R,3R)-4-acetyloxy-2,3-bis[(4-acetyloxy-3-methoxyphenyl)methyl]butyl] acetate	14521049	Click to see	530.60	unknown	via CMAUP database
Trigalloylglucose	90116889	Click to see	636.50	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6268091/
> Lignans, neolignans and related compounds / Dibenzylbutane lignans / Dibenzylbutanediol lignans
7-Hydroxysecoisolariciresinol	44566585	Click to see COC1=C(C=CC(=C1)CC(CO)C(CO)C(C2=CC(=C(C=C2)O)OC)O)O	378.40	unknown	via CMAUP database
Secoisolariciresinol	65373	Click to see COC1=C(C=CC(=C1)CC(CO)C(CC2=CC(=C(C=C2)O)OC)CO)O	362.40	unknown	via CMAUP database
Secoisolariciresinol, (+)-	6336781	Click to see	362.40	unknown	via CMAUP database
> Lignans, neolignans and related compounds / Furanoid lignans
(-) Syringaresinol	332426	Click to see COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC(=C(C(=C4)OC)O)OC	418.40	unknown	via CMAUP database
(-)-Pinoresinol	12309636	Click to see	358.40	unknown	via CMAUP database
(-)-Syringaresinol	11604108	Click to see COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC(=C(C(=C4)OC)O)OC	418.40	unknown	via CMAUP database
(+-)-Pinoresinol	234817	Click to see	358.40	unknown	via CMAUP database
4-[(3aR,6S,6aR)-6-(4-hydroxy-3-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenol	17750970	Click to see	358.40	unknown	via CMAUP database
4-[(3R,3aR,6R,6aR)-6-(4-hydroxy-3-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenol	12309637	Click to see COC1=C(C=CC(=C1)C2C3COC(C3CO2)C4=CC(=C(C=C4)O)OC)O	358.40	unknown	via CMAUP database
Epipinoresinol	637584	Click to see	358.40	unknown	via CMAUP database
Phylligenin	12314158	Click to see	372.40	unknown	via CMAUP database
Pinoresinol	73399	Click to see COC1=C(C=CC(=C1)C2C3COC(C3CO2)C4=CC(=C(C=C4)O)OC)O	358.40	unknown	via CMAUP database
Sesamin, (-)-	382073	Click to see	354.40	unknown	via CMAUP database
Syringaresinol	100067	Click to see	418.40	unknown	via CMAUP database
Syringaresinol, (+)-	443023	Click to see	418.40	unknown	via CMAUP database
> Lignans, neolignans and related compounds / Furanoid lignans / Tetrahydrofuran lignans / 9,9-epoxylignans
(+/-)-trans-3,4-Divanillyltetrahydrofuran	9906140	Click to see COC1=C(C=CC(=C1)CC2COCC2CC3=CC(=C(C=C3)O)OC)O	344.40	unknown	via CMAUP database
> Lignans, neolignans and related compounds / Lignan lactones
(-)-alpha-Conidendrin	72506	Click to see COC1=C(C=C2C(C3COC(=O)C3CC2=C1)C4=CC(=C(C=C4)O)OC)O	356.40	unknown	https://doi.org/10.1021/JF203598M
alpha-Peltatin	92129	Click to see COC1=CC(=CC(=C1O)OC)C2C3C(CC4=C(C5=C(C=C24)OCO5)O)COC3=O	400.40	unknown	via CMAUP database
beta-Peltatin	92122	Click to see	414.40	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Eicosanoids / Prostaglandins and related compounds
Methyl 15-hydroxy-9-oxoprosta-5,10,13-trien-1-oate	53393996	Click to see	348.50	unknown	https://doi.org/10.1007/BF00713328
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids
2-Dodecyl-3-Methylbutanedioic Acid	99891	Click to see CCCCCCCCCCCCC(C(C)C(=O)O)C(=O)O	300.40	unknown	via CMAUP database
9-Octadecenoic Acid	965	Click to see	282.50	unknown	https://doi.org/10.1021/JF010711W
Eicosanoic Acid	10467	Click to see	312.50	unknown	via CMAUP database
Elaidic Acid	637517	Click to see CCCCCCCCC=CCCCCCCCC(=O)O	282.50	unknown	via CMAUP database
Heneicosanoic Acid	16898	Click to see	326.60	unknown	https://doi.org/10.1093/JAOAC/55.3.645
Myristic Acid	11005	Click to see	228.37	unknown	via CMAUP database
Nonadecanoic Acid	12591	Click to see	298.50	unknown	https://doi.org/10.1093/JAOAC/55.3.645
Oleic Acid	445639	Click to see	282.50	unknown	https://doi.org/10.1021/JF010711W https://doi.org/10.1093/JAOAC/55.3.645
Oleic acid-d2	13011408	Click to see CCCCCCCCC=CCCCCCCCC(=O)O	284.50	unknown	via CMAUP database
Palmitelaidic acid	5282745	Click to see	254.41	unknown	via CMAUP database
Palmitic Acid	985	Click to see	256.42	unknown	https://doi.org/10.1093/JAOAC/55.3.645
Palmitoleic Acid	445638	Click to see CCCCCCC=CCCCCCCCC(=O)O	254.41	unknown	via CMAUP database
Stearic Acid	5281	Click to see	284.50	unknown	https://doi.org/10.1093/JAOAC/55.3.645
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Medium-chain fatty acids
4-Methyldodecanoic acid	4248419	Click to see CCCCCCCCC(C)CCC(=O)O	214.34	unknown	https://doi.org/10.1093/JAOAC/55.3.645
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Very long-chain fatty acids
(1-~13~C)Tetracosanoic acid	16213616	Click to see	369.60	unknown	via CMAUP database
Lignoceric Acid	11197	Click to see CCCCCCCCCCCCCCCCCCCCCCCC(=O)O	368.60	unknown	via CMAUP database
Nervonic Acid	5281120	Click to see CCCCCCCCC=CCCCCCCCCCCCCCC(=O)O	366.60	unknown	via CMAUP database
Tricosanoic Acid	17085	Click to see	354.60	unknown	https://doi.org/10.1093/JAOAC/55.3.645
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acyl glycosides / Fatty acyl glycosides of mono- and disaccharides
(2R,3S,4S,5R,6R)-2-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoxy]oxane-3,4,5-triol	11386564	Click to see	504.50	unknown	via CMAUP database
(2R,3S,4S,5R,6R)-2-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoxy]oxane-3,4,5-triol	162981461	Click to see COC1=C(C=CC(=C1)C=CCOC2C(C(C(C(O2)COC3C(C(CO3)(CO)O)O)O)O)O)O	474.50	unknown	https://doi.org/10.1021/NP0498051
I(2)-D-Glucopyranoside, (2E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenyl 6-O-D-apio-I(2)-D-furanosyl	11408873	Click to see COC1=C(C=CC(=C1)C=CCOC2C(C(C(C(O2)COC3C(C(CO3)(CO)O)O)O)O)O)O	474.50	unknown	https://doi.org/10.1021/NP0498051
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols
1-Hexanol	8103	Click to see CCCCCCO	102.17	unknown	via CMAUP database
cis-3-Hexen-1-ol	5281167	Click to see CCC=CCCO	100.16	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives
[(2R)-2,3-dihydroxypropyl] (9E,11Z,13E)-octadeca-9,11,13-trienoate	163082131	Click to see	352.50	unknown	https://doi.org/10.1021/JF010711W
9,12,15-Octadecatrienoic acid	860	Click to see CCC=CCC=CCC=CCCCCCCCC(=O)O	278.40	unknown	https://doi.org/10.3109/07435800903524161
Alpha-Eleostearic acid	5281115	Click to see	278.40	unknown	https://doi.org/10.3109/07435800903524161
Eleostearic acid	93077	Click to see	278.40	unknown	https://doi.org/10.3109/07435800903524161 https://doi.org/10.1007/S10637-005-5856-7
gamma-Linolenic acid	5280933	Click to see CCCCCC=CCC=CCC=CCCCCC(=O)O	278.40	unknown	https://doi.org/10.3109/07435800903524161
Linoleic Acid	5280450	Click to see CCCCCC=CCC=CCCCCCCCC(=O)O	280.40	unknown	via CMAUP database
Linolenic Acid	5280934	Click to see	278.40	unknown	https://doi.org/10.3109/07435800903524161
Octadeca-6,9,12-trienoic acid	3453	Click to see CCCCCC=CCC=CCC=CCCCCC(=O)O	278.40	unknown	https://doi.org/10.3109/07435800903524161
Punicic Acid	5281126	Click to see CCCCC=CC=CC=CCCCCCCCC(=O)O	278.40	unknown	https://doi.org/10.3109/07435800903524161 https://doi.org/10.1093/JAOAC/55.3.645 https://doi.org/10.1007/S10637-005-5856-7
> Lipids and lipid-like molecules / Glycerolipids / Diradylglycerols / 1-alkyl,3-acylglycerols
[(2R)-2-hydroxy-3-(3-methylbutoxy)propyl] (E)-octadec-2-enoate	163190958	Click to see CCCCCCCCCCCCCCCC=CC(=O)OCC(COCCC(C)C)O	426.70	unknown	https://doi.org/10.1021/JF010711W
[(2R)-2-hydroxy-3-(3-methylbutoxy)propyl] octadec-2-enoate	163029346	Click to see	426.70	unknown	https://doi.org/10.1021/JF010711W
> Lipids and lipid-like molecules / Glycerolipids / Triradylcglycerols / Triacylglycerols
[(2R)-2,3-bis[[(9Z,11E,13Z)-octadeca-9,11,13-trienoyl]oxy]propyl] (9Z,12Z,14E)-nonadeca-9,12,14-trienoate	163025003	Click to see	887.40	unknown	https://doi.org/10.1016/S0031-9422(96)00742-X
Glycerol trisinapate	5317745	Click to see COC1=CC(=CC(=C1O)OC)C=CC(=O)OCC(COC(=O)C=CC2=CC(=C(C(=C2)OC)O)OC)OC(=O)C=CC3=CC(=C(C(=C3)OC)O)OC	710.70	unknown	via CMAUP database
> Lipids and lipid-like molecules / Glycerophospholipids / Glycerophosphocholines / Phosphatidylcholines
Lecithin	5287971	Click to see CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCC=CCC=CCCCCC	758.10	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Kaurane diterpenoids
(4R,14R)-14-(chloromethyl)-5,5,9-trimethyltetracyclo[11.2.1.01,10.04,9]hexadecan-14-ol	24893863	Click to see	324.90	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Taxanes and derivatives
4,10-Bis(acetyloxy)-13-((3-benzamido-2-hydroxy-3-phenylpropanoyl)oxy)-1,7-dihydroxy-9-oxo-5,20-epoxytax-11-en-2-yl benzoate	4666	Click to see	853.90	unknown	via CMAUP database
Paclitaxel	36314	Click to see	853.90	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
Myrcene	31253	Click to see	136.23	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids
(-)-3-Carene	442461	Click to see CC1=CCC2C(C1)C2(C)C	136.23	unknown	via CMAUP database
(-)-Fenchone	82229	Click to see	152.23	unknown	via CMAUP database
(+-)-alpha-Pinene	6654	Click to see	136.23	unknown	via CMAUP database
(+-)-Fenchone	14525	Click to see	152.23	unknown	via CMAUP database
(+)-3-Carene	443156	Click to see	136.23	unknown	via CMAUP database
(+)-alpha-Pinene	82227	Click to see CC1=CCC2CC1C2(C)C	136.23	unknown	via CMAUP database
(+)-Fenchone	1201521	Click to see	152.23	unknown	via CMAUP database
(1R)-Camphor	230921	Click to see	152.23	unknown	via CMAUP database
(1s)-1,3,3-Trimethyl-norbornan-2-one	12049113	Click to see	152.23	unknown	via CMAUP database
(1S)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene	12223113	Click to see CC1=CCC2CC1C2(C)C	136.23	unknown	via CMAUP database
(4R)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-one	16213045	Click to see	152.23	unknown	via CMAUP database
(R)-Fenchone; L-(-)-Fenchone; L-Fenchone; l-Fenchone	2794921	Click to see CC1(C2CCC(C2)(C1=O)C)C	152.23	unknown	via CMAUP database
3-Carene	26049	Click to see CC1=CCC2C(C1)C2(C)C	136.23	unknown	via CMAUP database
Beta-Pinene	14896	Click to see	136.23	unknown	via CMAUP database
Camphor	2537	Click to see	152.23	unknown	via CMAUP database
Camphor, (-)-	444294	Click to see	152.23	unknown	via CMAUP database
Camphor, (1S)-	10050	Click to see	152.23	unknown	via CMAUP database
D-Borneol	6552009	Click to see	154.25	unknown	via CMAUP database
D-Camphor	159055	Click to see	152.23	unknown	via CMAUP database
Npc54264	9543187	Click to see	152.23	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids
(-)-Terpinen-4-ol	5325830	Click to see CC1=CCC(CC1)(C(C)C)O	154.25	unknown	via CMAUP database
(+)-Limonene	440917	Click to see	136.23	unknown	via CMAUP database
(+)-Terpinen-4-ol	2724161	Click to see CC1=CCC(CC1)(C(C)C)O	154.25	unknown	via CMAUP database
(L)-alpha-terpineol	443162	Click to see	154.25	unknown	via CMAUP database
4-Terpineol, (+/-)-	11230	Click to see CC1=CCC(CC1)(C(C)C)O	154.25	unknown	via CMAUP database
Alpha-Terpinene	7462	Click to see	136.23	unknown	via CMAUP database
Alpha-Terpineol	17100	Click to see	154.25	unknown	via CMAUP database
Limonene, (-)-	439250	Click to see	136.23	unknown	via CMAUP database
Limonene, (+/-)-	22311	Click to see CC1=CCC(CC1)C(=C)C	136.23	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Quinone and hydroquinone lipids / Vitamin E compounds / Tocopherols
(+)-gamma-Tocopherol	92729	Click to see	416.70	unknown	via CMAUP database
2H-1-Benzopyran-6-ol, 3,4-dihydro-2,8-dimethyl-2-(4,8,12-trimethyltridecyl)-, [2R-[2R(4R,8R*)]]-	586537	Click to see	402.70	unknown	via CMAUP database
Alpha-Tocopherol	14985	Click to see CC1=C(C2=C(CCC(O2)(C)CCCC(C)CCCC(C)CCCC(C)C)C(=C1O)C)C	430.70	unknown	via CMAUP database
Delta-Tocopherol	92094	Click to see CC1=CC(=CC2=C1OC(CC2)(C)CCCC(C)CCCC(C)CCCC(C)C)O	402.70	unknown	via CMAUP database
DL-alpha-Tocopherol	2116	Click to see	430.70	unknown	via CMAUP database
Tocopherols	14986	Click to see CC1=C(C=C2CCC(OC2=C1C)(C)CCCC(C)CCCC(C)CCCC(C)C)O	416.70	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
[(3R)-3-[(2S,5E)-6,10-dimethyl-1-oxoundeca-5,9-dien-2-yl]-2-formylcyclopenten-1-yl]methyl acetate	14139379	Click to see	360.50	unknown	https://doi.org/10.1016/S0031-9422(96)00742-X
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones
2-(4,8-dimethylnona-1,3,7-trienyl)-2,3,9-trimethyl-3H-furo[3,2-c]chromen-4-one	163009330	Click to see CC1C2=C(C3=C(C=CC=C3OC2=O)C)OC1(C)C=CC=C(C)CCC=C(C)C	378.50	unknown	https://doi.org/10.1021/JF101978Z
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Diterpene lactones
Villosin	16733738	Click to see CC1(CCCC2(C1CCC(=C)C2C=CC3=CCOC3=O)C)C	300.40	unknown	https://doi.org/10.1021/JF010711W
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
(+)-Ursolic Acid	64945	Click to see	456.70	unknown	https://doi.org/10.1248/CPB.56.1628
(10R)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid	45358157	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O	456.70	unknown	via CMAUP database
(18\|A)-Oleanolic acid	7048528	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C	456.70	unknown	https://doi.org/10.1248/CPB.56.1628
(1S,2R,4aR,6aR,6aR,6bR,8aS,10S,12aR,14aR,14bR)-2,10-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14,14a,14b-hexadecahydropicene-4a-carboxylic acid	154497314	Click to see	474.70	unknown	https://doi.org/10.1248/CPB.56.1628
(1S,2R,4aR,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid	45483617	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O	456.70	unknown	via CMAUP database
(1S,2R,4aS,6aR,6aS,6bR,8aS,9R,10R,11R,12aR,14bS)-10,11-dihydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid	51531959	Click to see	488.70	unknown	https://doi.org/10.1248/CPB.56.1628
(2S,3R,4S,5S,6R)-2-[(2S,3R,4S,5S)-2-[[(3S,4R,4aR,6aR,6bS,8R,8aS,12aS,14aR,14bR)-8-hydroxy-4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4,5-dihydroxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol	163042564	Click to see CC1(CCC2(C(C1)C3=CCC4C5(CCC(C(C5CCC4(C3(CC2O)C)C)(C)CO)OC6C(C(C(CO6)O)O)OC7C(C(C(C(O7)CO)O)O)O)C)CO)C	769.00	unknown	https://doi.org/10.1016/S0031-9422(96)00742-X
(4aR,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid	45483610	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C	456.70	unknown	via CMAUP database
(4aS,6aR,6aS,6bR,8aR,10R,11R,12aR,14bR)-10,11-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid	7163260	Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1)C)C(=O)O)C	472.70	unknown	https://doi.org/10.1248/CPB.56.1628
(4aS,6aS,6aS,6bR,8aS,10S,12aR,14bR)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid	51892422	Click to see	456.70	unknown	https://doi.org/10.1248/CPB.56.1628
2,10-Dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14,14a,14b-hexadecahydropicene-4a-carboxylic acid	74390928	Click to see CC1C2C3CCC4C5(CCC(C(C5CCC4(C3(CCC2(CCC1(C)O)C(=O)O)C)C)(C)C)O)C	474.70	unknown	https://doi.org/10.1248/CPB.56.1628
2,3-Dihydroxy-12-oleanen-28-oic acid	3694932	Click to see	472.70	unknown	https://doi.org/10.1016/J.FITOTE.2006.06.011 https://doi.org/10.1248/CPB.56.1628
2,3,24-Trihydroxy-12-ursen-28-oic acid	296191	Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1C)C)C(=O)O	488.70	unknown	https://doi.org/10.1248/CPB.56.1628
24-Hydroxyursolic Acid	44568920	Click to see	472.70	unknown	via CMAUP database
3-Epioleanolic acid	11869658	Click to see	456.70	unknown	via CMAUP database
3-Hydroxyolean-12-en-28-oic acid	619166	Click to see	456.70	unknown	https://doi.org/10.1248/CPB.56.1628
Asiatic Acid	119034	Click to see	488.70	unknown	https://doi.org/10.1248/CPB.56.1628
Beta-Sitosteryl Acetate	5354503	Click to see	456.70	unknown	via CMAUP database
Betulin	72326	Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)CO	442.70	unknown	via CMAUP database
Betulinic Acid	64971	Click to see	456.70	unknown	via CMAUP database
CID 3003153	3003153	Click to see	470.70	unknown	via CMAUP database
Epifriedelin	15559350	Click to see	426.70	unknown	via CMAUP database
Friedelan-3-one	244297	Click to see	426.70	unknown	via CMAUP database
Friedelin	91472	Click to see	426.70	unknown	via CMAUP database
Lupeol	259846	Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C	426.70	unknown	via CMAUP database
Maslinic Acid	73659	Click to see	472.70	unknown	https://doi.org/10.1016/J.FITOTE.2006.06.011 https://doi.org/10.1248/CPB.56.1628
Oleanolic Acid	10494	Click to see	456.70	unknown	https://doi.org/10.1248/CPB.56.1628
Punicanolic acid	25132490	Click to see CC1C2C3CCC4C5(CCC(C(C5CCC4(C3(CCC2(CCC1(C)O)C(=O)O)C)C)(C)C)O)C	474.70	unknown	https://doi.org/10.1248/CPB.56.1628
Urs-12-en-28-oic acid, 3-hydroxy-, (3beta)-	220774	Click to see	456.70	unknown	https://doi.org/10.1248/CPB.56.1628
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Cholestane steroids / Cholesterols and derivatives
Cholesterol	5997	Click to see	386.70	unknown	https://doi.org/10.1016/S0031-9422(96)00742-X
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Cycloartanols and derivatives
[(1R,3R,6S,7S,8R,11R,12S,15R,16R)-7,12,16-trimethyl-15-[(Z,2R)-5-propan-2-ylhept-5-en-2-yl]-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl] acetate	162984648	Click to see CC=C(CCC(C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5C)OC(=O)C)C)C)C(C)C	482.80	unknown	https://doi.org/10.1016/S0031-9422(96)00742-X
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids / Ergosterols and derivatives
Brassicasterol	5281327	Click to see CC(C)C(C)C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C	398.70	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Estrane steroids / Estrogens and derivatives
(13S)-3-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one	6710658	Click to see	270.40	unknown	via CMAUP database
(8S,9S,13S,14R)-3-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one	670995	Click to see CC12CCC3C(C1CCC2=O)CCC4=C3C=CC(=C4)O	270.40	unknown	via CMAUP database
(9beta)-3-Hydroxyestra-1,3,5(10)-trien-17-one	11869537	Click to see	270.40	unknown	via CMAUP database
13-Methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta(a)phenanthrene-3,17-diol	450	Click to see	272.40	unknown	https://doi.org/10.3109/07435800903524161
Estrone	5870	Click to see	270.40	unknown	https://doi.org/10.1016/S0021-9673(00)90278-4
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Pregnane steroids / Gluco/mineralocorticoids, progestogins and derivatives
[(3R,5S,8S,9S,10S,11R,13R,14S,17R)-17-ethenyl-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-11-yl] acetate	25180961	Click to see CC(=O)OC1CC2(C(CCC2C3C1C4(CCC(CC4CC3)O)C)C=C)C	360.50	unknown	https://doi.org/10.1007/BF02273936
1-[(3R,9S,10R,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone	53477678	Click to see	316.50	unknown	via CMAUP database
Pregnenolone	8955	Click to see CC(=O)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C	316.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
(-)-beta-Sitosterol	222284	Click to see	414.70	unknown	https://doi.org/10.1248/CPB.56.1628
(2R,3R,4S,5S,6S)-2-[[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol	154496016	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C	576.80	unknown	https://doi.org/10.1021/NP0498051
(3R,4S,5S,6R)-2-[[(3S,8S,9S,10R,13R,14S)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol	52940117	Click to see	576.80	unknown	via CMAUP database
17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol	86821	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	414.70	unknown	https://doi.org/10.1248/CPB.56.1628
beta-Sitosterol 3-O-beta-D-galactopyranoside	296119	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C	576.80	unknown	https://doi.org/10.1016/J.FITOTE.2006.06.011 https://doi.org/10.1021/NP0498051
Npc29	6432744	Click to see	414.70	unknown	via CMAUP database
Sitogluside	5742590	Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C	576.80	unknown	https://doi.org/10.1016/J.FITOTE.2006.06.011 https://doi.org/10.1021/NP0498051
Stigmast-5-en-3-ol	22012	Click to see	414.70	unknown	https://doi.org/10.1248/CPB.56.1628
Stigmasterol	5280794	Click to see	412.70	unknown	via CMAUP database
> Nucleosides, nucleotides, and analogues / Purine nucleosides
(2R,3R,4S,5R)-2-[6-[2-[cyclohexyl(methyl)amino]ethyl]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol	49772392	Click to see	391.50	unknown	via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Dicarboxylic acids and derivatives
CID 18676629	18676629	Click to see	90.03	unknown	via CMAUP database
CID 21952380	21952380	Click to see	118.09	unknown	via CMAUP database
Oxalic Acid	971	Click to see	90.03	unknown	https://doi.org/10.1006/JFCA.2002.1071
Oxalic acid-13C2 dihydrate	16213469	Click to see C(=O)(C(=O)O)O.O.O	128.05	unknown	via CMAUP database
Succinic Acid	1110	Click to see	118.09	unknown	https://doi.org/10.1006/JFCA.2002.1071
> Organic acids and derivatives / Carboxylic acids and derivatives / Tricarboxylic acids and derivatives
2-(Carboxymethyl)-2-hydroxybutanedioate;hydron	88113319	Click to see [H+].[H+].C(C(=O)O)C(CC(=O)[O-])(C(=O)[O-])O	192.12	unknown	via CMAUP database
Citric Acid	311	Click to see	192.12	unknown	https://doi.org/10.1006/JFCA.2002.1071
> Organic acids and derivatives / Hydroxy acids and derivatives / Beta hydroxy acids and derivatives
CID 20130941	20130941	Click to see	134.09	unknown	via CMAUP database
D-Malic acid	92824	Click to see	134.09	unknown	via CMAUP database
L-Malic Acid	222656	Click to see	134.09	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6268091/ https://doi.org/10.1006/JFCA.2002.1071
Sodium 3-carboxy-2-hydroxypropanoate	23681190	Click to see C(C(C(=O)[O-])O)C(=O)O.[Na+]	156.07	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds
CID 53627467	53627467	Click to see	60.08	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives
Chlorogenic Acid	1794427	Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O	354.31	unknown	https://doi.org/10.1006/JFCA.2002.1071
cis-Chlorogenic acid	1794425	Click to see	354.31	unknown	via CMAUP database
Isochlorogenic acid	5315832	Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O	354.31	unknown	via CMAUP database
Neochlorogenic acid	5280633	Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O	354.31	unknown	via CMAUP database
Quinic acid	6508	Click to see C1C(C(C(CC1(C(=O)O)O)O)O)O	192.17	unknown	https://doi.org/10.1006/JFCA.2002.1071
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Polyols / 1,2-diols
(1R)-1-(dioxiran-3-yl)ethane-1,2-diol	57339130	Click to see	106.08	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds
2-Phenylethyl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside	11166301	Click to see	430.40	unknown	https://doi.org/10.1021/NP0498051
Icariside D1	13893575	Click to see	416.40	unknown	https://doi.org/10.1021/NP0498051
Phenethyl rutinoside	14312558	Click to see	430.40	unknown	https://doi.org/10.1021/NP0498051
Phenylethanol + Hex-Pen	13893574	Click to see	416.40	unknown	https://doi.org/10.1021/NP0498051
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides
2-(4-Hydroxyphenoxy)-6-[3-(4-hydroxyphenyl)prop-2-enoxymethyl]oxane-3,4,5-triol	162890773	Click to see	404.40	unknown	https://doi.org/10.1007/BF00597820
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides / Heptoses
(3R,4S,5R,6R)-3,4,5,6,7-pentahydroxy-1-(3,4,5-trihydroxyphenyl)heptane-1,2-dione	21120298	Click to see	332.26	unknown	https://doi.org/10.1021/JF000404A
Sedoheptulose	5459879	Click to see C(C(C(C(C(C(=O)CO)O)O)O)O)O	210.18	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Sugar acids and derivatives
2,3-Dihydroxybutanedioic Acid	875	Click to see	150.09	unknown	https://doi.org/10.1006/JFCA.2002.1071
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Sugar alcohols
Galactitol	11850	Click to see	182.17	unknown	via CMAUP database
Glycerin	753	Click to see C(C(CO)O)O	92.09	unknown	via CMAUP database
Hexitol	453	Click to see C(C(C(C(C(CO)O)O)O)O)O	182.17	unknown	via CMAUP database
L-Iditol	5460044	Click to see	182.17	unknown	via CMAUP database
L-Mannitol	136460	Click to see	182.17	unknown	via CMAUP database
Mannitol	6251	Click to see	182.17	unknown	https://doi.org/10.1016/S0031-9422(00)83125-8
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Medium-chain aldehydes
cis-3-Hexenal	643941	Click to see CCC=CCC=O	98.14	unknown	via CMAUP database
Hexanal	6184	Click to see	100.16	unknown	via CMAUP database
Nonanal	31289	Click to see CCCCCCCCC=O	142.24	unknown	via CMAUP database
trans-2-Hexenal	5281168	Click to see	98.14	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Phenylketones / Alkyl-phenylketones
Xanthoxylin	66654	Click to see	196.20	unknown	https://doi.org/10.1016/S0031-9422(00)89820-9
> Organic oxygen compounds / Organooxygen compounds / Ethers / Dialkyl ethers
1-Methyl-3-propan-2-yloxycyclohexane	5319690	Click to see	156.26	unknown	via CMAUP database
> Organoheterocyclic compounds / Dihydrofurans / Furanones / Butenolides
D-ascorbic acid	54690394	Click to see C(C(C1C(=C(C(=O)O1)O)O)O)O	176.12	unknown	via CMAUP database
L-Ascorbic Acid	54670067	Click to see	176.12	unknown	via CMAUP database
Npc119107	54676536	Click to see	176.12	unknown	via CMAUP database
> Organoheterocyclic compounds / Piperidines
1-[(2S)-1-methylpiperidin-2-yl]propan-2-one	820378	Click to see CC(=O)CC1CCCCN1C	155.24	unknown	https://doi.org/10.1111/J.2042-7158.1950.TB13001.X
Methylisopelletierine	86786	Click to see CC(=O)CC1CCCCN1C	155.24	unknown	https://doi.org/10.1016/J.JEP.2006.09.006 https://doi.org/10.1111/J.2042-7158.1950.TB13001.X https://doi.org/10.1039/J39700001792
N-Methylpelletierine	1548928	Click to see CC(=O)CC1CCCCN1C	155.24	unknown	https://doi.org/10.1039/J39700001792
Pelletierine	3034881	Click to see	141.21	unknown	https://doi.org/10.1111/J.2042-7158.1950.TB13001.X
Pelletierine	92987	Click to see CC(=O)CC1CCCCN1	141.21	unknown	https://doi.org/10.1016/J.JEP.2006.09.006 https://doi.org/10.1111/J.2042-7158.1950.TB13001.X
Pelletierine, (+)-	10313185	Click to see	141.21	unknown	via CMAUP database
> Organoheterocyclic compounds / Piperidines / Piperidinones
9-Azabicyclo[3.3.1]nonan-3-one	145745	Click to see	139.19	unknown	https://doi.org/10.1016/J.JEP.2006.09.006
9-Methyl-9-azabicyclo[3.3.1]nonan-3-one	11096	Click to see CN1C2CCCC1CC(=O)C2	153.22	unknown	https://doi.org/10.1016/J.JEP.2006.09.006 https://doi.org/10.1111/J.2042-7158.1950.TB13001.X https://doi.org/10.1039/J39700001792
Pseudopelletierine	6602484	Click to see	153.22	unknown	https://doi.org/10.1111/J.2042-7158.1950.TB13001.X https://doi.org/10.1039/J39700001792
> Organoheterocyclic compounds / Pyridines and derivatives / Hydropyridines / Tetrahydropyridines
6-[(E)-prop-1-enyl]-2,3,4,5-tetrahydropyridine	15937508	Click to see CC=CC1=NCCCC1	123.20	unknown	https://doi.org/10.1016/S0031-9422(00)86011-2
6-Prop-1-enyl-2,3,4,5-tetrahydropyridine	76453742	Click to see CC=CC1=NCCCC1	123.20	unknown	https://doi.org/10.1016/S0031-9422(00)86011-2
> Organoheterocyclic compounds / Quinolines and derivatives / Quinolones and derivatives / Hydroquinolones
2-[(Z)-hex-3-enyl]-1,2,3,4-tetrahydrobenzo[c]quinolizin-6-one	10401479	Click to see CCC=CCCC1CCC2=CC(=O)C3=CC=CC=C3N2C1	281.40	unknown	https://doi.org/10.1016/S0031-9422(96)00888-6
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids
3-(2-Hydroxyphenyl)-2-propenoic acid	11968	Click to see	164.16	unknown	https://doi.org/10.1006/JFCA.2002.1071
3-(3,4-Dihydroxyphenyl)Prop-2-Enoic Acid	2518	Click to see	180.16	unknown	https://doi.org/10.1007/S10637-005-5856-7
3-(4-Hydroxy-3-Methoxyphenyl)Prop-2-Enoic Acid	709	Click to see	194.18	unknown	https://doi.org/10.1006/JFCA.2002.1071
4-Coumaric acid	322	Click to see	164.16	unknown	https://doi.org/10.1006/JFCA.2002.1071
Caffeic Acid	689043	Click to see	180.16	unknown	https://doi.org/10.1006/JFCA.2002.1071 https://doi.org/10.1007/S10637-005-5856-7
cis-Caffeic acid	1549111	Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O	180.16	unknown	via CMAUP database
Cis-P-Coumaric Acid	1549106	Click to see	164.16	unknown	via CMAUP database
Ferulic Acid	445858	Click to see	194.18	unknown	https://doi.org/10.1006/JFCA.2002.1071
O-Coumaric Acid	637540	Click to see	164.16	unknown	https://doi.org/10.1006/JFCA.2002.1071
P-Coumaric Acid	637542	Click to see	164.16	unknown	https://doi.org/10.1006/JFCA.2002.1071
> Phenylpropanoids and polyketides / Coumarins and derivatives
Urolithin A	5488186	Click to see C1=CC2=C(C=C1O)C(=O)OC3=C2C=CC(=C3)O	228.20	unknown	https://doi.org/10.1021/JF900725E
Urolithin B	5380406	Click to see	212.20	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 7,8-dihydroxycoumarins
ethyl (6R)-4-(2-ethoxy-2-oxoethyl)-11,12-dihydroxy-3,8-dioxo-2,7-dioxatricyclo[7.3.1.05,13]trideca-1(13),4,9,11-tetraene-6-carboxylate	162942104	Click to see CCOC(=O)CC1=C2C(OC(=O)C3=CC(=C(C(=C32)OC1=O)O)O)C(=O)OCC	392.30	unknown	https://doi.org/10.1016/J.FITOTE.2006.06.011
Ethyl 4-(2-ethoxy-2-oxoethyl)-11,12-dihydroxy-3,8-dioxo-2,7-dioxatricyclo[7.3.1.05,13]trideca-1(13),4,9,11-tetraene-6-carboxylate	156009855	Click to see	392.30	unknown	https://doi.org/10.1016/J.FITOTE.2006.06.011
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins
(-)-Catechol	73160	Click to see	290.27	unknown	via CMAUP database
(+)-Epicatechin	182232	Click to see	290.27	unknown	via CMAUP database
2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol	1203	Click to see	290.27	unknown	via CMAUP database
Catechin	9064	Click to see	290.27	unknown	https://doi.org/10.1006/JFCA.2002.1071
Epicatechin	72276	Click to see	290.27	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins / Catechin gallates
(-)-Epicatechin gallate	107905	Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O	442.40	unknown	https://doi.org/10.1021/JF000549H
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins / Epigallocatechins
(-)-Gallocatechin	9882981	Click to see	306.27	unknown	via CMAUP database
Gallocatechin	65084	Click to see	306.27	unknown	https://doi.org/10.1179/135100002125000172
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Flavanones
(R)-Pinocembrin	667544	Click to see	256.25	unknown	via CMAUP database
Pinocembrin	68071	Click to see C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=CC=C3	256.25	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavones
Apigenin	5280443	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O	270.24	unknown	https://doi.org/10.1016/J.JEP.2006.09.006
Luteolin	5280445	Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O)O	286.24	unknown	https://doi.org/10.1016/J.JEP.2006.09.006 https://doi.org/10.1248/CPB.56.1628 https://doi.org/10.1007/S10637-005-5856-7
Tricetin	5281701	Click to see C1=C(C=C(C(=C1O)O)O)C2=CC(=O)C3=C(C=C(C=C3O2)O)O	302.23	unknown	https://doi.org/10.1248/CPB.56.1628
> Phenylpropanoids and polyketides / Flavonoids / Flavones / Flavonols
Kaempferol	5280863	Click to see	286.24	unknown	https://doi.org/10.1016/J.JEP.2006.09.006
Myricetin	5281672	Click to see C1=C(C=C(C(=C1O)O)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O	318.23	unknown	via CMAUP database
Quercetin	5280343	Click to see	302.23	unknown	https://doi.org/10.1007/BF02273936 https://doi.org/10.1016/J.JEP.2006.09.006 https://doi.org/10.1006/JFCA.2002.1071 https://doi.org/10.1076/PHBI.39.2.155.6254
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Anthocyanins / Anthocyanidin-3-O-glycosides
(2R,3S,4R,5R,6S)-2-[5,7-dihydroxy-2-(4-hydroxyphenyl)chromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol	9867509	Click to see C1=CC(=CC=C1C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)CO)O)O)O)O)O)O	433.40	unknown	https://doi.org/10.1007/BF01192733 https://doi.org/10.1021/JF000404A
(2R,4S,5R)-2-[[(3S,6S)-6-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol	44256716	Click to see	595.50	unknown	via CMAUP database
(3R,4S,5S,6R)-2-[2-(3,4-Dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol	12303203	Click to see C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)CO)O)O)O)O)O)O)O	449.40	unknown	via CMAUP database
Chrysanthemin	44256715	Click to see	449.40	unknown	https://doi.org/10.1007/BF02273936
cyanidin 3-O-glucoside	197081	Click to see	484.80	unknown	via CMAUP database
Cyanidin 3-rutinoside (chloride);Cyanidin 3-O-rutinoside (chloride);Sambucin (chloride)	14034150	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC4=C(C=C(C=C4[O+]=C3C5=CC(=C(C=C5)O)O)O)O)O)O)O)O)O)O.[Cl-]	631.00	unknown	via CMAUP database
Cyanidin-3-glucoside	92131208	Click to see C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)CO)O)O)O)O)O)O)O	449.40	unknown	via CMAUP database
Delphinidin 3-glucoside chloride	165558	Click to see C1=C(C=C(C(=C1O)O)O)C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)CO)O)O)O)O)O.[Cl-]	500.80	unknown	via CMAUP database
Delphinidin 3-O-glucoside cation	443650	Click to see C1=C(C=C(C(=C1O)O)O)C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)CO)O)O)O)O)O	465.40	unknown	https://doi.org/10.1007/BF01192733 https://doi.org/10.1021/JF000404A
Keracyanin	29231	Click to see	631.00	unknown	via CMAUP database
Keracyanin cation	441674	Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC4=C(C=C(C=C4[O+]=C3C5=CC(=C(C=C5)O)O)O)O)O)O)O)O)O)O	595.50	unknown	via CMAUP database
Kuromanin	441667	Click to see C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)CO)O)O)O)O)O)O)O	449.40	unknown	https://doi.org/10.1021/JF000404A https://doi.org/10.1007/BF01192733
Npc244061	12303221	Click to see	484.80	unknown	via CMAUP database
Pelargonidin 3-O-glucoside	443648	Click to see	433.40	unknown	https://doi.org/10.1007/BF01192733 https://doi.org/10.1021/JF000404A
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Anthocyanins / Anthocyanidin-5-O-glycosides
(2S,4S,5S)-2-[2-(3,4-dihydroxyphenyl)-7-hydroxy-3-[(2S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromenylium-5-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol	44256718	Click to see C1=CC(=C(C=C1C2=C(C=C3C(=CC(=CC3=[O+]2)O)OC4C(C(C(C(O4)CO)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O)O	611.50	unknown	via CMAUP database
(3S,4S,6S)-2-(hydroxymethyl)-6-[7-hydroxy-3-[(2S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-(3,4,5-trihydroxyphenyl)chromenylium-5-yl]oxyoxane-3,4,5-triol	44256888	Click to see	627.50	unknown	https://doi.org/10.1007/BF02273936
Cyanidin chloride 3,5-diglucoside	164999	Click to see	647.00	unknown	via CMAUP database
Cyanin	441688	Click to see	611.50	unknown	https://doi.org/10.1007/BF01192733 https://doi.org/10.1021/JF000404A
Delphinidin 3,5-diglucoside	10100906	Click to see	627.50	unknown	https://doi.org/10.1007/BF01192733 https://doi.org/10.1021/JF000404A
Pelargonin	441772	Click to see	595.50	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides
5,7-Dihydroxy-2-[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one	13377094	Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O	432.40	unknown	https://doi.org/10.1016/S0031-9422(00)89552-7
5,7-Dihydroxy-2-[4-hydroxy-3-(3,4,5-trihydroxyoxan-2-yl)oxyphenyl]chromen-4-one	74977643	Click to see C1C(C(C(C(O1)OC2=C(C=CC(=C2)C3=CC(=O)C4=C(C=C(C=C4O3)O)O)O)O)O)O	418.30	unknown	https://doi.org/10.1016/S0031-9422(00)89552-7
5,7-dihydroxy-2-[4-hydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyphenyl]chromen-4-one	101675298	Click to see C1C(C(C(C(O1)OC2=C(C=CC(=C2)C3=CC(=O)C4=C(C=C(C=C4O3)O)O)O)O)O)O	418.30	unknown	https://doi.org/10.1016/S0031-9422(00)89552-7
5,7-Dihydroxy-2-[4-hydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one	12309349	Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O	448.40	unknown	https://doi.org/10.1016/S0031-9422(00)89552-7
Apigenin 4'-O-beta-D-glucopyranoside	5491384	Click to see	432.40	unknown	https://doi.org/10.1016/S0031-9422(00)89552-7
Luteolin 3'-glucoside	12309350	Click to see	448.40	unknown	https://doi.org/10.1016/S0031-9422(00)89552-7
Luteolin-4'-o-glucoside	5319116	Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O)OC4C(C(C(C(O4)CO)O)O)O	448.40	unknown	https://doi.org/10.1016/S0031-9422(00)89552-7
Luteolin-4'-o-glucoside	12304737	Click to see	448.40	unknown	https://doi.org/10.1016/S0031-9422(00)89552-7
Phlorizin	6072	Click to see	436.40	unknown	https://doi.org/10.1006/JFCA.2002.1071
Phlorizine	4789	Click to see	436.40	unknown	https://doi.org/10.1006/JFCA.2002.1071
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
Npc229608	25201902	Click to see	626.50	unknown	via CMAUP database
pelargonidin-3-O-beta-D-glucoside	443649	Click to see	432.40	unknown	https://doi.org/10.1007/BF02273936
pelargonidin-3,5-di-O-beta-D-glucoside	167643	Click to see	594.50	unknown	https://doi.org/10.1007/BF01192733
Rutin	5280805	Click to see	610.50	unknown	https://doi.org/10.1016/J.JEP.2006.09.006
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides
(2S)-2-(2,5-dihydroxy-4-methoxyphenyl)-5,6,8-trihydroxy-7-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2,3-dihydrochromen-4-one	162895369	Click to see COC1=C(C=C(C(=C1)O)C2CC(=O)C3=C(C(=C(C(=C3O2)O)OC4C(C(C(CO4)O)O)O)O)O)O	482.40	unknown	https://doi.org/10.1007/S10600-010-9568-7
2-(2,5-Dihydroxy-4-methoxyphenyl)-5,6,8-trihydroxy-7-(3,4,5-trihydroxyoxan-2-yl)oxy-2,3-dihydrochromen-4-one	162895368	Click to see	482.40	unknown	https://doi.org/10.1007/S10600-010-9568-7
2-(3,4-Dihydroxyphenyl)-3,5-dihydroxy-4-oxo-4H-1-benzopyran-7-yl hexopyranoside	5381351	Click to see	464.40	unknown	https://doi.org/10.1007/BF02273936
2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-7-[(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one	44259225	Click to see	464.40	unknown	https://doi.org/10.1007/BF02273936
7-[(2S,3R,4S,5S,6R)-6-[[(2S,3R,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3-methoxychromen-4-one	162878569	Click to see	624.50	unknown	https://doi.org/10.1076/PHBI.39.2.155.6254
Amurensin	5318156	Click to see	534.50	unknown	via CMAUP database
Phellatin	44258781	Click to see CC(C)(CCC1=C(C=C2C(=C1O)C(=O)C(=C(O2)C3=CC=C(C=C3)O)O)OC4C(C(C(C(O4)CO)O)O)O)O	534.50	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Hydroxyflavonoids / 7-hydroxyflavonoids
2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-1-Benzopyrylium	128861	Click to see	287.24	unknown	via CMAUP database
Flavylium, 3,3',4',5,5',7-hexahydroxy-	128853	Click to see C1=C(C=C(C(=C1O)O)O)C2=[O+]C3=CC(=CC(=C3C=C2O)O)O	303.24	unknown	https://doi.org/10.1007/BF00597820
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 4-O-methylated flavonoids
(2S)-5,6,7,8-tetrahydroxy-2-(2,3,5-trihydroxy-4-methoxyphenyl)-2,3-dihydrochromen-4-one	162926145	Click to see	366.28	unknown	https://doi.org/10.1007/S10600-010-9568-7
5,6,7,8,2',3',5'-Heptahydroxy-4'-methoxyflavanone	129882348	Click to see	366.28	unknown	https://doi.org/10.1007/S10600-010-9568-7
> Phenylpropanoids and polyketides / Isocoumarins and derivatives
(1R)-7,8,9-trihydroxy-3,5-dioxo-1,2-dihydrocyclopenta[c]isochromene-1-carboxylic acid	102004656	Click to see	292.20	unknown	https://doi.org/10.1016/S0031-9422(00)89820-9 https://doi.org/10.1016/S0031-9422(02)00435-1
7,8,9-Trihydroxy-1,2-dihydrocyclopenta[c]isochromene-3,5-dione	10131135	Click to see	248.19	unknown	https://doi.org/10.1016/S0031-9422(00)89820-9
Brevifolincarboxylic acid	9838995	Click to see	292.20	unknown	https://doi.org/10.1016/S0031-9422(00)89820-9 https://doi.org/10.1055/S-2003-41107 https://doi.org/10.1016/S0031-9422(96)00888-6 https://doi.org/10.1016/S0031-9422(02)00435-1
ethyl (1R)-7,8,9-trihydroxy-3,5-dioxo-1,2-dihydrocyclopenta[c]isochromene-1-carboxylate	162850267	Click to see	320.25	unknown	https://doi.org/10.1016/J.FITOTE.2006.06.011
Ethyl brevifolincarboxylate	5487248	Click to see	320.25	unknown	https://doi.org/10.1016/J.FITOTE.2006.06.011
> Phenylpropanoids and polyketides / Isoflavonoids / Coumestans
Coumestrol	5281707	Click to see C1=CC2=C(C=C1O)OC3=C2C(=O)OC4=C3C=CC(=C4)O	268.22	unknown	https://doi.org/10.1016/S0021-9673(00)90278-4
> Phenylpropanoids and polyketides / Isoflavonoids / Isoflav-2-enes / Isoflavones
Daidzein	5281708	Click to see	254.24	unknown	https://doi.org/10.1016/S0021-9673(00)90278-4
Genistein	5280961	Click to see	270.24	unknown	https://doi.org/10.1016/S0021-9673(00)90278-4
> Phenylpropanoids and polyketides / Isoflavonoids / Isoflavonoid O-glycosides
Daidzin	107971	Click to see	416.40	unknown	https://doi.org/10.1016/S0021-9673(00)90278-4
Genistin	5281377	Click to see	432.40	unknown	https://doi.org/10.1016/S0021-9673(00)90278-4
> Phenylpropanoids and polyketides / Linear 1,3-diarylpropanoids / Chalcones and dihydrochalcones / 2-Hydroxy-dihydrochalcones
Phloretin	4788	Click to see	274.27	unknown	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6268091/
> Phenylpropanoids and polyketides / Tannins
.beta-Penta-O-galloyl-D-glucose	374874	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5)O)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O	940.70	unknown	https://doi.org/10.1016/S0031-9422(00)83125-8
[4,5-Dihydroxy-3,6-bis[(3,4,5-trihydroxybenzoyl)oxy]oxan-2-yl]methyl 3,4,5-trihydroxybenzoate	14284610	Click to see	636.50	unknown	https://doi.org/10.1016/S0031-9422(00)89820-9
1,2,3-Tri-O-galloyl-beta-D-glucose	5322038	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OC2C(C(OC(C2OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)CO)O	636.50	unknown	https://doi.org/10.1016/S0031-9422(00)89820-9
1,2,4-tri-O-galloyl-beta-glucopyranose	88204715	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OC2C(OC(C(C2O)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)CO	636.50	unknown	https://doi.org/10.1016/S0031-9422(96)00888-6
1,2,4-Trigalloyl-beta-D-glucopyranose	15596071	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OC2C(OC(C(C2O)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)CO	636.50	unknown	https://doi.org/10.1016/S0031-9422(96)00888-6
1,2,4,6-Tetragalloyl-beta-D-glucopyranose	14464350	Click to see	788.60	unknown	https://doi.org/10.1016/S0031-9422(00)83125-8
1,2,4,6-Tetragalloylglucose	11297287	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)O)OC(=O)C5=CC(=C(C(=C5)O)O)O	788.60	unknown	https://doi.org/10.1016/S0031-9422(00)83125-8
1,2,6-Tri-O-Galloyl-Beta-D-Glucose	440308	Click to see	636.50	unknown	https://doi.org/10.1016/S0031-9422(00)89820-9 https://doi.org/10.1248/CPB.56.1628
1,2,6-Trigalloyl-beta-D-glucopyranose	3357644	Click to see	636.50	unknown	https://doi.org/10.1016/S0031-9422(00)89820-9 https://doi.org/10.1248/CPB.56.1628
1,3,4-tri-O-galloyl-beta-glucopyranose	16066749	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OC2C(OC(C(C2OC(=O)C3=CC(=C(C(=C3)O)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)CO	636.50	unknown	https://doi.org/10.1016/S0031-9422(96)00888-6
1,4,6-Tri-O-Galloyl-Beta-D-Glucose	10077822	Click to see	636.50	unknown	https://doi.org/10.1016/S0031-9422(00)89820-9
galloyl(-2)[galloyl(-3)]Hex-O-galloyl	13270009	Click to see	636.50	unknown	https://doi.org/10.1016/S0031-9422(00)89820-9
galloyl(-4)Glc(b1-6)Glc(b)-O-galloyl	162844808	Click to see	646.50	unknown	https://doi.org/10.1016/J.FITOTE.2009.01.013
galloyl(-4)Hex(?1-6)Hex-O-galloyl	162844807	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OC2C(OC(C(C2O)O)OCC3C(C(C(C(O3)OC(=O)C4=CC(=C(C(=C4)O)O)O)O)O)O)CO	646.50	unknown	https://doi.org/10.1016/J.FITOTE.2009.01.013
Penta-O-galloyl-beta-D-glucose	65238	Click to see	940.70	unknown	https://doi.org/10.1016/S0031-9422(00)83125-8
> Phenylpropanoids and polyketides / Tannins / Hydrolyzable tannins
(1,16,17,18,21,22,23,34,35,39,39-Undecahydroxy-2,5,13,26,31-pentaoxo-6,9,12,27,30,40-hexaoxaoctacyclo[34.3.1.04,38.07,28.010,29.014,19.020,25.032,37]tetraconta-3,14,16,18,20,22,24,32,34,36-decaen-8-yl) 3,4,5-trihydroxybenzoate	131752181	Click to see	952.60	unknown	https://doi.org/10.1248/CPB.34.720 https://doi.org/10.1248/BPB.16.787 https://doi.org/10.1016/S0031-9422(00)89820-9 https://doi.org/10.1016/S0031-9422(00)83125-8 https://doi.org/10.1021/NP50040A016 https://doi.org/10.1007/BF02273936
(10R,11R,13R,14R,15S)-3,4,5,11,14,20,21,22-octahydroxy-13-(hydroxymethyl)-9,12,16-trioxatetracyclo[16.4.0.02,7.010,15]docosa-1(22),2,4,6,18,20-hexaene-8,17-dione	11754973	Click to see	482.30	unknown	https://doi.org/10.1248/CPB.34.650
(10R,11R)-10-[(14R,15S,19R)-2,3,4,7,8,9,19-heptahydroxy-12,17-dioxo-13,16-dioxatetracyclo[13.3.1.05,18.06,11]nonadeca-1,3,5(18),6,8,10-hexaen-14-yl]-3,4,5,11,17,18,19,22,23,34,35-undecahydroxy-9,13,25,32-tetraoxaheptacyclo[25.8.0.02,7.015,20.021,30.024,29.028,33]pentatriaconta-1(35),2,4,6,15,17,19,21,23,27,29,33-dodecaene-8,14,26,31-tetrone	44584736	Click to see C1C(C(OC(=O)C2=CC(=C(C(=C2C3=C(C(=C4C5=C3C(=O)OC6=C(C(=C(C7=C(C(=C(C=C7C(=O)O1)O)O)O)C(=C56)C(=O)O4)O)O)O)O)O)O)O)C8C9C(C1=C(C(=C(C(=C1C(=O)O9)C1=C(C(=C(C=C1C(=O)O8)O)O)O)O)O)O)O)O	1084.70	unknown	https://doi.org/10.1248/CPB.34.656
(10R,11R)-10-[(14R,15S,19S)-2,3,4,7,8,9,19-heptahydroxy-12,17-dioxo-13,16-dioxatetracyclo[13.3.1.05,18.06,11]nonadeca-1,3,5(18),6,8,10-hexaen-14-yl]-3,4,5,11,17,18,19,22,23,34,35-undecahydroxy-9,13,25,32-tetraoxaheptacyclo[25.8.0.02,7.015,20.021,30.024,29.028,33]pentatriaconta-1(35),2,4,6,15,17,19,21,23,27,29,33-dodecaene-8,14,26,31-tetrone	153274273	Click to see	1084.70	unknown	https://doi.org/10.1248/CPB.34.656
(10R,11R)-10-[(14S,15R,19R)-2,3,4,7,8,9,19-heptahydroxy-12,17-dioxo-13,16-dioxatetracyclo[13.3.1.05,18.06,11]nonadeca-1,3,5(18),6,8,10-hexaen-14-yl]-3,4,5,11,17,18,19,22,23,34,35-undecahydroxy-9,13,25,32-tetraoxaheptacyclo[25.8.0.02,7.015,20.021,30.024,29.028,33]pentatriaconta-1(35),2,4,6,15,17,19,21,23,27,29,33-dodecaene-8,14,26,31-tetrone	44567110	Click to see C1C(C(OC(=O)C2=CC(=C(C(=C2C3=C(C(=C4C5=C3C(=O)OC6=C(C(=C(C7=C(C(=C(C=C7C(=O)O1)O)O)O)C(=C56)C(=O)O4)O)O)O)O)O)O)O)C8C9C(C1=C(C(=C(C(=C1C(=O)O9)C1=C(C(=C(C=C1C(=O)O8)O)O)O)O)O)O)O)O	1084.70	unknown	via CMAUP database
(10R,11R)-10-[(14S,15S,19R)-2,3,4,7,8,9,19-heptahydroxy-12,17-dioxo-13,16-dioxatetracyclo[13.3.1.05,18.06,11]nonadeca-1,3,5(18),6,8,10-hexaen-14-yl]-3,4,5,11,16,17,18,21,22,33,34-undecahydroxy-9,24,31-trioxaheptacyclo[24.8.0.02,7.014,19.020,29.023,28.027,32]tetratriaconta-1(34),2,4,6,14,16,18,20,22,26,28,32-dodecaene-8,13,25,30-tetrone	162883503	Click to see	1068.70	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
(10R,11S)-10-[(14S,15R,19S)-2,3,4,7,8,9,19-heptahydroxy-12,17-dioxo-13,16-dioxatetracyclo[13.3.1.05,18.06,11]nonadeca-1,3,5(18),6,8,10-hexaen-14-yl]-3,4,5,11,17,18,19,22,23,34,35-undecahydroxy-9,13,25,32-tetraoxaheptacyclo[25.8.0.02,7.015,20.021,30.024,29.028,33]pentatriaconta-1(35),2,4,6,15,17,19,21,23,27,29,33-dodecaene-8,14,26,31-tetrone	154497311	Click to see	1084.70	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
(10R,11S)-3,4,5,16,17,18-hexahydroxy-8,13-dioxo-11-[(10S,11S)-3,4,5,11,17,18,19,22,23,34,35-undecahydroxy-8,14,26,31-tetraoxo-9,13,25,32-tetraoxaheptacyclo[25.8.0.02,7.015,20.021,30.024,29.028,33]pentatriaconta-1(35),2,4,6,15,17,19,21,23,27,29,33-dodecaen-10-yl]-9,12-dioxatricyclo[12.4.0.02,7]octadeca-1(18),2,4,6,14,16-hexaene-10-carbaldehyde	154497312	Click to see	1084.70	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
(10S,11R,12R,13S,15R)-3,4,5,11,12,13,21,22,23,26,27,38,39-tridecahydroxy-9,14,17,29,36-pentaoxaoctacyclo[29.8.0.02,7.010,15.019,24.025,34.028,33.032,37]nonatriaconta-1(39),2,4,6,19,21,23,25,27,31,33,37-dodecaene-8,18,30,35-tetrone	11018190	Click to see C1C2C(C(C(C(O2)O)O)O)OC(=O)C3=CC(=C(C(=C3C4=C(C(=C5C6=C4C(=O)OC7=C(C(=C(C8=C(C(=C(C=C8C(=O)O1)O)O)O)C(=C67)C(=O)O5)O)O)O)O)O)O)O	782.50	unknown	via CMAUP database
(10S,11R,12R,15S)-3,4,5,11,12,13,21,22,23,26,27,38,39-tridecahydroxy-9,14,17,29,36-pentaoxaoctacyclo[29.8.0.02,7.010,15.019,24.025,34.028,33.032,37]nonatriaconta-1(39),2,4,6,19,21,23,25,27,31,33,37-dodecaene-8,18,30,35-tetrone	44567214	Click to see	782.50	unknown	via CMAUP database
(15R)-3,4,5,11,12,13,21,22,23,26,27,38,39-tridecahydroxy-9,14,17,29,36-pentaoxaoctacyclo[29.8.0.02,7.010,15.019,24.025,34.028,33.032,37]nonatriaconta-1(39),2,4,6,19,21,23,25,27,31,33,37-dodecaene-8,18,30,35-tetrone	134694222	Click to see	782.50	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1 https://doi.org/10.1248/CPB.34.650 https://doi.org/10.1007/BF02273936 https://doi.org/10.1021/NP50040A016
(1R,2S,8R,10R,19R,20S,39S)-8,9,9,13,14,25,26,27,30,31,32,39-dodecahydroxy-3,18,21,36,38,40-hexaoxaoctacyclo[18.17.1.12,19.18,12.05,10.011,16.023,28.029,34]tetraconta-5,11,13,15,23,25,27,29,31,33-decaene-4,7,17,22,35-pentone	163060266	Click to see	800.50	unknown	https://doi.org/10.1016/S0031-9422(00)83125-8
(1R,35R,37S,38R,55S)-6,7,8,11,12,23,24,27,28,29,37,43,44,45,48,49,50-heptadecahydroxy-2,14,21,33,36,39,54-heptaoxaundecacyclo[33.20.0.04,9.010,19.013,18.016,25.017,22.026,31.038,55.041,46.047,52]pentapentaconta-4,6,8,10,12,16,18,22,24,26,28,30,41,43,45,47,49,51-octadecaene-3,15,20,32,40,53-hexone	16149716	Click to see C1C2C(C3C(C(O2)O)OC(=O)C4=CC(=C(C(=C4C5=C(C(=C(C=C5C(=O)O3)O)O)O)O)O)O)OC(=O)C6=CC(=C(C(=C6C7=C(C(=C8C9=C7C(=O)OC2=C(C(=C(C3=C(C(=C(C=C3C(=O)O1)O)O)O)C(=C92)C(=O)O8)O)O)O)O)O)O)O	1084.70	unknown	via CMAUP database
(1R,35R,38R,55S)-6,7,8,11,12,23,24,27,28,29,37,43,44,45,48,49,50-heptadecahydroxy-2,14,21,33,36,39,54-heptaoxaundecacyclo(33.20.0.04,9.010,19.013,18.016,25.017,22.026,31.038,55.041,46.047,52)pentapentaconta-4,6,8,10,12,16,18,22,24,26,28,30,41,43,45,47,49,51-octadecaene-3,15,20,32,40,53-hexone	44584733	Click to see	1084.70	unknown	https://doi.org/10.1021/NP50040A016 https://doi.org/10.1590/S0103-50532002000500010 https://doi.org/10.1021/JF000404A https://doi.org/10.1248/BPB.16.787 https://doi.org/10.1007/BF02977896 https://doi.org/10.1007/BF02273936 https://doi.org/10.1021/JF020842C https://doi.org/10.1016/S0031-9422(02)00435-1 https://doi.org/10.1248/CPB.34.650
(1R,35S,38R,55S)-6,7,8,11,12,23,24,27,28,29,37,43,44,45,48,49,50-heptadecahydroxy-2,14,21,33,36,39,54-heptaoxaundecacyclo[33.20.0.04,9.010,19.013,18.016,25.017,22.026,31.038,55.041,46.047,52]pentapentaconta-4,6,8,10,12,16,18,22,24,26,28,30,41,43,45,47,49,51-octadecaene-3,15,20,32,40,53-hexone	44567213	Click to see C1C2C(C3C(C(O2)O)OC(=O)C4=CC(=C(C(=C4C5=C(C(=C(C=C5C(=O)O3)O)O)O)O)O)O)OC(=O)C6=CC(=C(C(=C6C7=C(C(=C8C9=C7C(=O)OC2=C(C(=C(C3=C(C(=C(C=C3C(=O)O1)O)O)O)C(=C92)C(=O)O8)O)O)O)O)O)O)O	1084.70	unknown	via CMAUP database
(1S,2R,20R,42R)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-4,17,22,40,44-pentaoxo-3,18,21,41,43-pentaoxaoctacyclo[27.13.3.02,20.05,10.011,16.023,28.033,45.034,39]pentatetraconta-5,7,9,11,13,15,23,25,27,29(45),30,32,34,36,38-pentadecaene-42-carboxylic acid	16142456	Click to see C1C2C(C3C(OC(=O)C4=CC(=C(C(=C4C5=C(C(=C(C(=C5C(=O)O3)C6=C(C(=C(C=C6C(=O)O2)O)O)O)O)O)O)O)O)O)C(=O)O)OC(=O)C7=CC(=C(C(=C7C8=C(C(=C(C=C8C(=O)O1)O)O)O)O)O)O	950.60	unknown	via CMAUP database
(26R,27S,44R,47R)-3,4,15,16,19,20,21,32,33,34,37,38,39,45,52,53,54-heptadecahydroxy-6,13,25,28,43,46,49-heptaoxaundecacyclo[49.3.1.02,11.05,10.08,17.09,14.018,23.026,47.027,44.030,35.036,41]pentapentaconta-1(55),2,4,8,10,14,16,18,20,22,30,32,34,36,38,40,51,53-octadecaene-7,12,24,29,42,50-hexone	24978505	Click to see	1084.70	unknown	via CMAUP database
(2R,3R)-2,3-dihydroxy-3-[(10R,11S)-3,4,5,11,17,18,19,22,23,34,35-undecahydroxy-8,14,26,31-tetraoxo-9,13,25,32-tetraoxaheptacyclo[25.8.0.02,7.015,20.021,30.024,29.028,33]pentatriaconta-1(35),2,4,6,15,17,19,21,23,27,29,33-dodecaen-10-yl]propanal	154497313	Click to see	782.50	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
(3,4,5,11,12,21,22,23-Octahydroxy-8,18-dioxo-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaen-13-yl) 3,4,5-trihydroxybenzoate	13917511	Click to see	634.50	unknown	https://doi.org/10.1016/S0031-9422(00)83125-8
(3,4,5,11,13,21,22,23,26,27,38,39-Dodecahydroxy-8,18,30,35-tetraoxo-9,14,17,29,36-pentaoxaoctacyclo[29.8.0.02,7.010,15.019,24.025,34.028,33.032,37]nonatriaconta-1(39),2,4,6,19,21,23,25,27,31,33,37-dodecaen-12-yl) 3,4,5-trihydroxybenzoate	75052135	Click to see C1C2C(C(C(C(O2)O)OC(=O)C3=CC(=C(C(=C3)O)O)O)O)OC(=O)C4=CC(=C(C(=C4C5=C(C(=C6C7=C5C(=O)OC8=C(C(=C(C9=C(C(=C(C=C9C(=O)O1)O)O)O)C(=C78)C(=O)O6)O)O)O)O)O)O)O	934.60	unknown	https://doi.org/10.1248/CPB.34.650
(3,4,5,11,14,20,21,22-Octahydroxy-8,17-dioxo-9,12,16-trioxatetracyclo[16.4.0.02,7.010,15]docosa-1(22),2,4,6,18,20-hexaen-13-yl)methyl 3,4,5-trihydroxybenzoate	14428071	Click to see	634.50	unknown	https://doi.org/10.1248/CPB.34.650
(5,6,7,8,11,12,13,14,22,23-Decahydroxy-3,16-dioxo-2,17,20-trioxatetracyclo[17.3.1.04,9.010,15]tricosa-4(9),5,7,10(15),11,13-hexaen-21-yl) 3,4,5-trihydroxybenzoate	162971987	Click to see	666.40	unknown	https://doi.org/10.1016/S0031-9422(00)89820-9
[(10R,11R,13R,14R,15S)-3,4,5,11,14,20,21,22-octahydroxy-8,17-dioxo-9,12,16-trioxatetracyclo[16.4.0.02,7.010,15]docosa-1(22),2,4,6,18,20-hexaen-13-yl]methyl 3,4,5-trihydroxybenzoate	14428069	Click to see	634.50	unknown	https://doi.org/10.1248/CPB.34.650
[(10R,11R)-10-[(14R,15R,19R)-2,3,4,7,8,9,19-heptahydroxy-12,17-dioxo-13,16-dioxatetracyclo[13.3.1.05,18.06,11]nonadeca-1,3,5(18),6,8,10-hexaen-14-yl]-3,4,5,16,17,18,21,22,33,34-decahydroxy-8,13,25,30-tetraoxo-9,24,31-trioxaheptacyclo[24.8.0.02,7.014,19.020,29.023,28.027,32]tetratriaconta-1(34),2,4,6,14,16,18,20,22,26,28,32-dodecaen-11-yl] 3,4,5-trihydroxybenzoate	163006263	Click to see	1220.80	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
[(10R,11R)-10-[(15S,19S)-2,3,4,7,8,9,19-heptahydroxy-12,17-dioxo-13,16-dioxatetracyclo[13.3.1.05,18.06,11]nonadeca-1,3,5(18),6,8,10-hexaen-14-yl]-3,4,5,17,18,19-hexahydroxy-8,14-dioxo-9,13-dioxatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-11-yl] 3,4,5-trihydroxybenzoate	101601178	Click to see C1C(C(OC(=O)C2=CC(=C(C(=C2C3=C(C(=C(C=C3C(=O)O1)O)O)O)O)O)O)C4C5C(C6=C(C(=C(C(=C6C(=O)O5)C7=C(C(=C(C=C7C(=O)O4)O)O)O)O)O)O)O)OC(=O)C8=CC(=C(C(=C8)O)O)O	936.60	unknown	https://doi.org/10.1248/BPB.16.787 https://doi.org/10.1248/CPB.34.656
[(10R,11S,12R,13S,15S)-3,4,5,11,21,22,23-heptahydroxy-8,18-dioxo-13-(3,4,5-trihydroxybenzoyl)oxy-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaen-12-yl] 3,4,5-trihydroxybenzoate	162959404	Click to see C1C2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)O)OC(=O)C5=CC(=C(C(=C5C6=C(C(=C(C=C6C(=O)O1)O)O)O)O)O)O	786.60	unknown	https://doi.org/10.1248/CPB.56.1628
[(10R,11S)-10-[(14R,15S,19S)-2,3,4,7,8,9,19-heptahydroxy-12,17-dioxo-13,16-dioxatetracyclo[13.3.1.05,18.06,11]nonadeca-1,3,5(18),6,8,10-hexaen-14-yl]-3,4,5,17,18,19-hexahydroxy-8,14-dioxo-9,13-dioxatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-11-yl] 3,4,5-trihydroxybenzoate	17999934	Click to see	936.60	unknown	https://doi.org/10.1248/CPB.34.656
[(10R,11S)-3,4,5,17,18,19,22,23,34,35-decahydroxy-10,11-dimethyl-8,14,26,31-tetraoxo-10-[(1S)-1-[(3R,4R)-4,5,6,7-tetrahydroxy-3-methyl-1-oxo-4H-isochromen-3-yl]-1-(3,4,5-trihydroxybenzoyl)oxyethyl]-9,13,25,32-tetraoxaheptacyclo[25.8.0.02,7.015,20.021,30.024,29.028,33]pentatriaconta-1(35),2,4,6,15,17,19,21,23,27,29,33-dodecaen-11-yl] 3,4,5-trihydroxybenzoate	162851938	Click to see CC1(COC(=O)C2=CC(=C(C(=C2C3=C(C(=C4C5=C3C(=O)OC6=C(C(=C(C7=C(C(=C(C=C7C(=O)OC1(C)C(C)(C8(C(C9=C(C(=C(C=C9C(=O)O8)O)O)O)O)C)OC(=O)C1=CC(=C(C(=C1)O)O)O)O)O)O)C(=C56)C(=O)O4)O)O)O)O)O)O)O)OC(=O)C1=CC(=C(C(=C1)O)O)O	1294.90	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
[(10S,11R)-10-[(14S,15R,19S)-2,3,4,7,8,9,19-heptahydroxy-12,17-dioxo-13,16-dioxatetracyclo[13.3.1.05,18.06,11]nonadeca-1,3,5(18),6,8,10-hexaen-14-yl]-3,4,5,17,18,19,22,23,34,35-decahydroxy-8,14,26,31-tetraoxo-9,13,25,32-tetraoxaheptacyclo[25.8.0.02,7.015,20.021,30.024,29.028,33]pentatriaconta-1(35),2,4,6,15,17,19,21,23,27,29,33-dodecaen-11-yl] 3,4,5-trihydroxybenzoate	154496046	Click to see	1236.80	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
[(10S,11S,12R,13R,15R)-3,4,5,11,13,21,22,23,26,27,38,39-dodecahydroxy-8,18,30,35-tetraoxo-9,14,17,29,36-pentaoxaoctacyclo[29.8.0.02,7.010,15.019,24.025,34.028,33.032,37]nonatriaconta-1(39),2,4,6,19,21,23,25,27,31,33,37-dodecaen-12-yl] 3,4,5-trihydroxybenzoate	101136622	Click to see	934.60	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
[(10S,11S,12R,13S,15R)-3,4,5,11,13,21,22,23,26,27,38,39-dodecahydroxy-8,18,30,35-tetraoxo-9,14,17,29,36-pentaoxaoctacyclo[29.8.0.02,7.010,15.019,24.025,34.028,33.032,37]nonatriaconta-1(39),2,4,6,19,21,23,25,27,31,33,37-dodecaen-12-yl] 3,4,5-trihydroxybenzoate	163048086	Click to see C1C2C(C(C(C(O2)O)OC(=O)C3=CC(=C(C(=C3)O)O)O)O)OC(=O)C4=CC(=C(C(=C4C5=C(C(=C6C7=C5C(=O)OC8=C(C(=C(C9=C(C(=C(C=C9C(=O)O1)O)O)O)C(=C78)C(=O)O6)O)O)O)O)O)O)O	934.60	unknown	https://doi.org/10.1248/CPB.34.650
[(1R,19R,21S,22R,23R)-6,7,8,11,12,13,22-heptahydroxy-3,16-dioxo-21-(3,4,5-trihydroxybenzoyl)oxy-2,17,20-trioxatetracyclo[17.3.1.04,9.010,15]tricosa-4,6,8,10,12,14-hexaen-23-yl] 3,4,5-trihydroxybenzoate	14411426	Click to see	786.60	unknown	https://doi.org/10.1016/S0031-9422(96)00888-6
[(1R,19S,21R,22R,23S)-6,7,8,11,12,13-hexahydroxy-3,16-dioxo-21,22-bis[(3,4,5-trihydroxybenzoyl)oxy]-2,17,20-trioxatetracyclo[17.3.1.04,9.010,15]tricosa-4,6,8,10,12,14-hexaen-23-yl] 3,4,5-trihydroxybenzoate	157874172	Click to see C1C2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5C6=C(C(=C(C=C6C(=O)O1)O)O)O)O)O)O)OC(=O)C7=CC(=C(C(=C7)O)O)O	938.70	unknown	https://doi.org/10.1248/CPB.34.650
[(1R,2R)-1-[(15S,19S)-2,3,4,7,8,9,19-heptahydroxy-12,17-dioxo-13,16-dioxatetracyclo[13.3.1.05,18.06,11]nonadeca-1,3,5(18),6,8,10-hexaen-14-yl]-1,3-dihydroxypropan-2-yl] 3,4,5-trihydroxybenzoate	101630966	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OC(CO)C(C2C3C(C4=C(C(=C(C(=C4C(=O)O3)C5=C(C(=C(C=C5C(=O)O2)O)O)O)O)O)O)O)O	634.50	unknown	https://doi.org/10.1248/CPB.34.656
[(1R,2R)-2-hydroxy-3-oxo-1-[(10R,11R)-3,4,5,11,17,18,19,22,23,34,35-undecahydroxy-8,14,26,31-tetraoxo-9,13,25,32-tetraoxaheptacyclo[25.8.0.02,7.015,20.021,30.024,29.028,33]pentatriaconta-1(35),2,4,6,15,17,19,21,23,27,29,33-dodecaen-10-yl]propyl] 3,4,5-trihydroxybenzoate	154496182	Click to see	934.60	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
[(1R,2S)-1-[(14S,15R,19R)-2,3,4,7,8,9,19-heptahydroxy-12,17-dioxo-13,16-dioxatetracyclo[13.3.1.05,18.06,11]nonadeca-1,3,5(18),6,8,10-hexaen-14-yl]-1,3-dihydroxypropan-2-yl] 3,4,5-trihydroxybenzoate	162994708	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OC(CO)C(C2C3C(C4=C(C(=C(C(=C4C(=O)O3)C5=C(C(=C(C=C5C(=O)O2)O)O)O)O)O)O)O)O	634.50	unknown	https://doi.org/10.1248/CPB.34.656
[(1S,19R,21S,22R,23R)-5,6,7,8,11,12,13,14-octahydroxy-3,16-dioxo-21,22-bis[(3,4,5-trihydroxybenzoyl)oxy]-2,17,20-trioxatetracyclo[17.3.1.04,9.010,15]tricosa-4(9),5,7,10(15),11,13-hexaen-23-yl] 3,4,5-trihydroxybenzoate	162857441	Click to see	970.70	unknown	https://doi.org/10.1016/S0031-9422(00)89820-9
[(1S,19R,21S,22R,23R)-5,6,7,8,11,12,13,14,22,23-decahydroxy-3,16-dioxo-2,17,20-trioxatetracyclo[17.3.1.04,9.010,15]tricosa-4(9),5,7,10(15),11,13-hexaen-21-yl] 3,4,5-trihydroxybenzoate	163190909	Click to see	666.40	unknown	https://doi.org/10.1016/S0031-9422(00)89820-9
[(1S,19R,21S,22R,23S)-6,7,8,11,12,13,22,23-octahydroxy-3,16-dioxo-2,17,20-trioxatetracyclo[17.3.1.04,9.010,15]tricosa-4,6,8,10,12,14-hexaen-21-yl] 3,4,5-trihydroxybenzoate	154496377	Click to see	634.50	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
[(8R,9S,27R,29S,30R,36S,37R,38R)-2,3,14,15,16,19,20,21,36,37-decahydroxy-6,11,24,32,35-pentaoxo-36-(2-oxopropyl)-7,10,25,28,31,40-hexaoxaoctacyclo[35.2.1.05,39.08,27.09,30.012,17.018,23.033,38]tetraconta-1(39),2,4,12,14,16,18,20,22,33-decaen-29-yl] 3,4,5-trihydroxybenzoate	101601927	Click to see	992.70	unknown	via CMAUP database
[1-(2,3,4,7,8,9,19-Heptahydroxy-12,17-dioxo-13,16-dioxatetracyclo[13.3.1.05,18.06,11]nonadeca-1,3,5(18),6,8,10-hexaen-14-yl)-1,3-dihydroxypropan-2-yl] 3,4,5-trihydroxybenzoate	14035445	Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OC(CO)C(C2C3C(C4=C(C(=C(C(=C4C(=O)O3)C5=C(C(=C(C=C5C(=O)O2)O)O)O)O)O)O)O)O	634.50	unknown	https://doi.org/10.1248/CPB.34.656
[10-(2,3,4,7,8,9,19-Heptahydroxy-12,17-dioxo-13,16-dioxatetracyclo[13.3.1.05,18.06,11]nonadeca-1,3,5(18),6,8,10-hexaen-14-yl)-3,4,5,16,17,18,21,22,33,34-decahydroxy-8,13,25,30-tetraoxo-9,24,31-trioxaheptacyclo[24.8.0.02,7.014,19.020,29.023,28.027,32]tetratriaconta-1(34),2,4,6,14,16,18,20,22,26,28,32-dodecaen-11-yl] 3,4,5-trihydroxybenzoate	163006262	Click to see	1220.80	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
[10-(2,3,4,7,8,9,19-Heptahydroxy-12,17-dioxo-13,16-dioxatetracyclo[13.3.1.05,18.06,11]nonadeca-1,3,5(18),6,8,10-hexaen-14-yl)-3,4,5,17,18,19-hexahydroxy-8,14-dioxo-9,13,25,32-tetraoxaheptacyclo[25.8.0.02,7.015,20.021,30.024,29.028,33]pentatriaconta-1(35),2,4,6,15,17,19,21,23,26,28,30,33-tridecaen-11-yl] 3,4,5-trihydroxybenzoate	101219413	Click to see	1142.80	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
[3,4,5,11,21,22,23-Heptahydroxy-8,18-dioxo-13-(3,4,5-trihydroxybenzoyl)oxy-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaen-12-yl] 3,4,5-trihydroxybenzoate	146253567	Click to see	786.60	unknown	https://doi.org/10.1248/CPB.56.1628
[3,4,5,17,18,19,22,23,34,35-decahydroxy-10,11-dimethyl-8,14,26,31-tetraoxo-10-[1-(4,5,6,7-tetrahydroxy-3-methyl-1-oxo-4H-isochromen-3-yl)-1-(3,4,5-trihydroxybenzoyl)oxyethyl]-9,13,25,32-tetraoxaheptacyclo[25.8.0.02,7.015,20.021,30.024,29.028,33]pentatriaconta-1(35),2,4,6,15,17,19,21,23,27,29,33-dodecaen-11-yl] 3,4,5-trihydroxybenzoate	16133864	Click to see CC1(COC(=O)C2=CC(=C(C(=C2C3=C(C(=C4C5=C3C(=O)OC6=C(C(=C(C7=C(C(=C(C=C7C(=O)OC1(C)C(C)(C8(C(C9=C(C(=C(C=C9C(=O)O8)O)O)O)O)C)OC(=O)C1=CC(=C(C(=C1)O)O)O)O)O)O)C(=C56)C(=O)O4)O)O)O)O)O)O)O)OC(=O)C1=CC(=C(C(=C1)O)O)O	1294.90	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
[5,6,7,8,11,12,13,14-Octahydroxy-3,16-dioxo-21,22-bis[(3,4,5-trihydroxybenzoyl)oxy]-2,17,20-trioxatetracyclo[17.3.1.04,9.010,15]tricosa-4(9),5,7,10(15),11,13-hexaen-23-yl] 3,4,5-trihydroxybenzoate	162857440	Click to see C1C2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=C(C6=C(C(=C(C(=C6O)O)O)O)C(=O)O1)C(=C(C(=C5O)O)O)O)OC(=O)C7=CC(=C(C(=C7)O)O)O	970.70	unknown	https://doi.org/10.1016/S0031-9422(00)89820-9
1-Epi-castalagin	12302512	Click to see	934.60	unknown	via CMAUP database
1,2,3,16,17,18-Hexahydroxy-5,14-dioxo-5,7,8,11,12,14-hexahydro-10h-8,12-methanodibenzo(j,l)(1,4,8)trioxacyclotetradecine-10,11,19-triyl tris(3,4,5-trihydroxybenzoate)	475273	Click to see	938.70	unknown	https://doi.org/10.1016/S0031-9422(00)83125-8
1,4-Di-O-galloyl-3,6-(R)-hexahydroxydiphenoyl-b-D-glucopyranose	14411424	Click to see	786.60	unknown	https://doi.org/10.1016/S0031-9422(96)00888-6
10-(2,3,4,7,8,9,19-Heptahydroxy-12,17-dioxo-13,16-dioxatetracyclo[13.3.1.05,18.06,11]nonadeca-1,3,5(18),6,8,10-hexaen-14-yl)-3,4,5,11,16,17,18,21,22,33,34-undecahydroxy-9,24,31-trioxaheptacyclo[24.8.0.02,7.014,19.020,29.023,28.027,32]tetratriaconta-1(34),2,4,6,14,16,18,20,22,26,28,32-dodecaene-8,13,25,30-tetrone	162883502	Click to see C1C(C(OC(=O)C2=CC(=C(C(=C2C3=C(C(=C4C5=C3C(=O)OC6=C(C(=C(C7=C(C(=C(C=C7C1=O)O)O)O)C(=C56)C(=O)O4)O)O)O)O)O)O)O)C8C9C(C1=C(C(=C(C(=C1C(=O)O9)C1=C(C(=C(C=C1C(=O)O8)O)O)O)O)O)O)O)O	1068.70	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
13-Hydroxy-12-methoxy-3,5,10,17-tetraoxapentacyclo[9.6.2.02,6.08,18.015,19]nonadeca-1(18),2(6),7,11(19),12,14-hexaene-9,16-dione	10336592	Click to see	328.23	unknown	via CMAUP database
14-(3,4,5,11,17,18,19-Heptahydroxy-8,14-dioxo-9,13-dioxatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl)-2,3,4,7,8,9,19-heptahydroxy-13,16-dioxatetracyclo[13.3.1.05,18.06,11]nonadeca-1,3,5(18),6,8,10-hexaene-12,17-dione	14035439	Click to see C1C(C(OC(=O)C2=CC(=C(C(=C2C3=C(C(=C(C=C3C(=O)O1)O)O)O)O)O)O)C4C5C(C6=C(C(=C(C(=C6C(=O)O5)C7=C(C(=C(C=C7C(=O)O4)O)O)O)O)O)O)O)O	784.50	unknown	https://doi.org/10.1248/CPB.34.656
2,3-Hexahydroxydiphenoylglucopyranose	492390	Click to see	482.30	unknown	https://doi.org/10.1248/CPB.34.650
2,3,8-Tri-O-methylellagic acid	5281860	Click to see COC1=C(C2=C3C(=C1)C(=O)OC4=C3C(=CC(=C4OC)O)C(=O)O2)OC	344.30	unknown	https://doi.org/10.1021/NP0498051
3-O-methylellagic acid	13915428	Click to see COC1=C(C=C2C3=C1OC(=O)C4=CC(=C(C(=C43)OC2=O)O)O)O	316.22	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1 https://doi.org/10.1055/S-2003-41107
3-O-Methylellagic acid 4-O-rhamnoside	16720461	Click to see CC1C(C(C(C(O1)OC2=C(C3=C4C(=C2)C(=O)OC5=C4C(=CC(=C5O)O)C(=O)O3)OC)O)O)O	462.40	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
3,3'-di-O-Methylellagic acid	5488919	Click to see	330.24	unknown	https://doi.org/10.1021/NP0498051
3,3a(2),4a(2)-Tri-O-methylellagic acid	11674590	Click to see COC1=C(C2=C3C(=C1)C(=O)OC4=C3C(=CC(=C4OC)OC)C(=O)O2)O	344.30	unknown	https://doi.org/10.1016/J.FITOTE.2006.06.011
3,4,8,9,10-Pentahydroxybenzo[c]chromen-6-one	18504424	Click to see C1=CC(=C(C2=C1C3=C(C(=C(C=C3C(=O)O2)O)O)O)O)O	276.20	unknown	https://doi.org/10.1016/S0031-9422(00)89820-9
4,4'-Di-O-methylellagic acid	11580745	Click to see	330.24	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
5-Desgalloylstachyurin	10417809	Click to see C1C(C(OC(=O)C2=CC(=C(C(=C2C3=C(C(=C(C=C3C(=O)O1)O)O)O)O)O)O)C4C5C(C6=C(C(=C(C(=C6C(=O)O5)C7=C(C(=C(C=C7C(=O)O4)O)O)O)O)O)O)O)O	784.50	unknown	https://doi.org/10.1248/CPB.34.656
6-[[(2R,3S,4S,5R,6S)-6-[(2S,3R,4S,5R,6S)-4,5-dihydroxy-2-methyl-6-[(7,13,14-trihydroxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaen-6-yl)oxy]oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-7,13,14-trihydroxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione	11968423	Click to see	894.60	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
6-[[(2R,3S,4S,5R,6S)-6-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-2-methyl-6-[(7,13,14-trihydroxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaen-6-yl)oxy]oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-7,13,14-trihydroxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione	163005628	Click to see	894.60	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
6-[[6-[4,5-Dihydroxy-2-methyl-6-[(7,13,14-trihydroxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaen-6-yl)oxy]oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-7,13,14-trihydroxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione	73157032	Click to see CC1C(C(C(C(O1)OC2=C(C3=C4C(=C2)C(=O)OC5=C4C(=CC(=C5O)O)C(=O)O3)O)O)O)OC6C(C(C(C(O6)COC7=C(C8=C9C(=C7)C(=O)OC1=C9C(=CC(=C1O)O)C(=O)O8)O)O)O)O	894.60	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
6,7-Dihydroxy-14-methoxy-13-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione	73310005	Click to see CC1C(C(C(C(O1)OC2=C(C3=C4C(=C2)C(=O)OC5=C4C(=CC(=C5O)O)C(=O)O3)OC)O)O)O	462.40	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
7-Hydroxy-6,14-dimethoxy-13-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione	162978331	Click to see	476.40	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
7-hydroxy-6,14-dimethoxy-13-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione	162978332	Click to see	476.40	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1
8-O-[(1R,19R,21R,22R,23R)-6,7,8,11,12,13,22-heptahydroxy-3,16-dioxo-21-(3,4,5-trihydroxybenzoyl)oxy-2,17,20-trioxatetracyclo[17.3.1.04,9.010,15]tricosa-4,6,8,10,12,14-hexaen-23-yl] 1-O-methyl (1R,3aR,8bR)-5,6-dihydroxy-3a-(2-methoxy-2-oxoethyl)-3-oxo-1,8b-dihydrofuro[3,4-b][1]benzofuran-1,8-dicarboxylate	71475292	Click to see	998.70	unknown	via CMAUP database
8,9,9,13,14,25,26,27,30,31,32,39-Dodecahydroxy-3,18,21,36,38,40-hexaoxaoctacyclo[18.17.1.12,19.18,12.05,10.011,16.023,28.029,34]tetraconta-5,11,13,15,23,25,27,29,31,33-decaene-4,7,17,22,35-pentone	73989171	Click to see	800.50	unknown	https://doi.org/10.1016/S0031-9422(00)83125-8
alpha-Pedunculagin	13834142	Click to see C1C2C(C3C(C(O2)O)OC(=O)C4=CC(=C(C(=C4C5=C(C(=C(C=C5C(=O)O3)O)O)O)O)O)O)OC(=O)C6=CC(=C(C(=C6C7=C(C(=C(C=C7C(=O)O1)O)O)O)O)O)O	784.50	unknown	https://doi.org/10.1248/CPB.34.650
beta-Punicalagin	16148440	Click to see	1084.70	unknown	https://doi.org/10.1248/CPB.34.650 https://doi.org/10.1055/S-2007-967167
Castalagin	12302513	Click to see	934.60	unknown	via CMAUP database
Casuariin	14035442	Click to see C1C(C(OC(=O)C2=CC(=C(C(=C2C3=C(C(=C(C=C3C(=O)O1)O)O)O)O)O)O)C4C5C(C6=C(C(=C(C(=C6C(=O)O5)C7=C(C(=C(C=C7C(=O)O4)O)O)O)O)O)O)O)O	784.50	unknown	https://doi.org/10.1248/CPB.34.656
Casuarinin	442673	Click to see C1C(C(OC(=O)C2=CC(=C(C(=C2C3=C(C(=C(C=C3C(=O)O1)O)O)O)O)O)O)C4C5C(C6=C(C(=C(C(=C6C(=O)O5)C7=C(C(=C(C=C7C(=O)O4)O)O)O)O)O)O)O)OC(=O)C8=CC(=C(C(=C8)O)O)O	936.60	unknown	https://doi.org/10.1248/BPB.16.787 https://doi.org/10.1248/CPB.34.656
Casuarinin	13834145	Click to see	936.60	unknown	via CMAUP database
CID 3002104	3002104	Click to see	934.60	unknown	via CMAUP database
CID 442690	442690	Click to see C1C2C(C(C(C(O2)O)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5C6=C(C(=C(C=C6C(=O)O1)O)O)O)O)O)O	786.60	unknown	https://doi.org/10.1248/BPB.16.787
CID 5464368	5464368	Click to see C1C2C(C(C(C(O2)O)O)O)OC(=O)C3=CC(=C(C(=C3C4=C(C(=C5C6=C4C(=O)OC7=C(C(=C(C8=C(C(=C(C=C8C(=O)O1)O)O)O)C(=C67)C(=O)O5)O)O)O)O)O)O)O	782.50	unknown	https://doi.org/10.1016/S0031-9422(02)00435-1 https://doi.org/10.1248/CPB.34.650 https://doi.org/10.1007/BF02273936 https://doi.org/10.1021/NP50040A016 https://doi.org/10.1055/S-2007-967167
Corilagin	73568	Click to see C1C2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)O)OC(=O)C4=CC(=C(C(=C4C5=C(C(=C(C=C5C(=O)O1)O)O)O)O)O)O)O	634.50	unknown	https://doi.org/10.1248/BPB.16.787 https://doi.org/10.1007/BF02273936 https://doi.org/10.1016/S0031-9422(02)00435-1 https://doi.org/10.1016/S0031-9422(00)89820-9 https://doi.org/10.1016/S0031-9422(00)83125-8
Corilagin (Standard)	5089683	Click to see	634.50	unknown	https://doi.org/10.1016/S0031-9422(00)83125-8
Ellagic Acid	5281855	Click to see	302.19	unknown	https://doi.org/10.1007/BF02977896 https://doi.org/10.1076/PHBI.39.2.155.6254 https://doi.org/10.1248/BPB.16.787 https://doi.org/10.1055/S-2007-967167 https://doi.org/10.1016/S0031-9422(02)00435-1 https://doi.org/10.1007/BF02273936 https://doi.org/10.1016/J.JNUTBIO.2005.01.006 https://doi.org/10.1007/S10637-005-5856-7 https://doi.org/10.1021/JF000404A https://doi.org/10.1016/J.FITOTE.2006.06.011 https://doi.org/10.1016/S0031-9422(00)89820-9 https://doi.org/10.1016/S0031-9422(96)00888-6 https://doi.org/10.1021/JF900725E
Ellagic acid glucoside	91072206	Click to see C1=C2C3=C(C(=C1O)O)OC(=O)C4=CC(=C(C(=C43)OC2=O)O)OC5C(C(C(C(O5)CO)O)O)O	464.30	unknown	https://doi.org/10.1021/JF000404A
Eschweilenol C	10026656	Click to see	448.30	unknown	via CMAUP database
Flavogallonic acid	14503023	Click to see	470.30	unknown	via CMAUP database
Gallagic acid	14754405	Click to see	638.40	unknown	https://doi.org/10.1055/S-2007-967167
Gallagyldilactone	5281711	Click to see	602.40	unknown	via CMAUP database
GlyTouCan:G69718UQ	9918701	Click to see	786.60	unknown	via CMAUP database
Granatin A	131752596	Click to see	784.50	unknown	https://doi.org/10.1248/CPB.34.720 https://doi.org/10.1248/BPB.16.787 https://doi.org/10.1016/S0031-9422(00)83125-8 https://doi.org/10.1021/NP50040A016
Kzeyiyxacmutrm-uhfffaoysa-	44631480	Click to see	802.60	unknown	https://doi.org/10.1248/CPB.34.656
Lagerstannin C	10394485	Click to see	650.50	unknown	via CMAUP database
Npc255833	20056239	Click to see	634.50	unknown	https://doi.org/10.1248/CPB.34.656
Npc88069	92131301	Click to see	782.50	unknown	via CMAUP database
Npc88976	16129869	Click to see	1084.70	unknown	https://doi.org/10.1021/NP50040A016 https://doi.org/10.1055/S-2007-967167 https://doi.org/10.1021/JF000404A https://doi.org/10.1016/J.JNUTBIO.2005.01.006 https://doi.org/10.1248/BPB.16.787 https://doi.org/10.1007/BF02977896 https://doi.org/10.1007/BF02273936 https://doi.org/10.1590/S0103-50532002000500030 https://doi.org/10.1021/JF020842C https://doi.org/10.1016/S0031-9422(02)00435-1 https://doi.org/10.1248/CPB.34.650
Pedunculagin	442688	Click to see	784.50	unknown	https://doi.org/10.1248/BPB.16.787 https://doi.org/10.1248/CPB.34.650
Pedunculagin I	492391	Click to see	784.50	unknown	https://doi.org/10.1248/CPB.34.650
Punicacortein D	16129720	Click to see	1084.70	unknown	https://doi.org/10.1248/CPB.34.656 https://doi.org/10.1016/S0031-9422(02)00435-1
Punicafolin	5320800	Click to see	938.70	unknown	https://doi.org/10.1248/CPB.34.650 https://doi.org/10.1016/S0031-9422(00)83125-8 https://doi.org/10.1016/S0031-9422(00)89820-9
Punicalin	5388496	Click to see C1C2C(C(C(C(O2)O)O)O)OC(=O)C3=CC(=C(C(=C3C4=C(C(=C5C6=C4C(=O)OC7=C(C(=C(C8=C(C(=C(C=C8C(=O)O1)O)O)O)C(=C67)C(=O)O5)O)O)O)O)O)O)O	782.50	unknown	https://doi.org/10.1055/S-2007-967167 https://doi.org/10.1248/CPB.34.650
Punigluconin	21637585	Click to see	802.60	unknown	https://doi.org/10.1248/CPB.34.656
Stachyurin	157395	Click to see	936.60	unknown	https://doi.org/10.1248/CPB.34.656
Strictinin	73330	Click to see	634.50	unknown	https://doi.org/10.1016/S0031-9422(00)83125-8
Valoneic acid dilactone	10151874	Click to see C1=C2C3=C(C(=C1O)O)OC(=O)C4=CC(=C(C(=C43)OC2=O)O)OC5=C(C(=C(C=C5C(=O)O)O)O)O	470.30	unknown	via CMAUP database
Vescalagin	168165	Click to see	934.60	unknown	via CMAUP database

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Punica granatum

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Ethnobotanical Use Top

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