Scientific name	Authority	First published in
Actaea cimicifuga var. simplex	DC.	Prodr. 1: 64 1824
Actaea yesoensis	(Nakai) J.Compton & Hedd.	Taxon 47: 624 (1998)
Cimicifuga dahurica var. tschonoskii	Huth	Bot. Jahrb. Syst. 16: 317 1893
Cimicifuga foetida var. intermedia	Regel	Reis. Ostsib. 1: 121 1861
Cimicifuga foetida f. laciniata	Makino	Fl. Japan 966 1925
Cimicifuga foetida f. purpurea	Makino	J. Jap. Bot. 3: 39 1926
Cimicifuga foetida var. simplex	(DC.) G.Don	Gen. Hist. 1: 64 1831
Cimicifuga ramosa	(Maxim. ex Franch. & Sav.) Nakai	Index Seminum (TI) 1932: 15 1932
Cimicifuga simplex	Wormsk. ex DC.	Bull. Soc. Imp. Naturalistes Moscou 15: 87 (1842)
Cimicifuga simplex var. ramosa	Maxim. ex Franch. & Sav.	Enum. Pl. Jap. 1: 13 1875
Cimicifuga simplex var. yesoensis	Nakai	Bot. Mag. (Tokyo) 30: 146 1916
Cimicifuga taquetii	H.Lév.	Repert. Spec. Nov. Regni Veg. 9: 448 (1911)
Cimicifuga ussuriensis	Oett.	Trudy Bot. Sada Imp. Yur'evsk. Univ. 6: 138 (1906)
Cimicifuga yezoensis	Kudô	J. Coll. Agric. Hokkaido Imp. Univ. 12: 36 (1923)
Cimicifuga simplex var. intermedia	(Regel) Nakai	Bot. Mag. (Tokyo) 30: 146 1916
Cimicifuga foetida var. simplex	(DC.) Regel	Tent. Fl. Ussur. 13 1861
Thalictrodes simplex	Kuntze	Revis. Gen. Pl. 1: 4 (1891)

Common names Top

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Filter by language:

Language	Common/alternative name
English	cimicifuga simplex
Spanish	cimicifuga simplex
Azerbaijani	sadə simisifuqa
Azerbaijani	sadə qarğaotu
German	september-silberkerze
French	cimicifuga simplex
Japanese	ショウマ
Japanese	升麻
Japanese	サラシナショウマ
Korean	촛대승마
Chinese	单穗升麻
Chinese	單穗升麻

Subspecies (abbr. subsp./ssp.) Top

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No subspecies added yet.

Varieties (abbr. var.) Top

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No variety added yet.

Subvarieties (abbr. subvar.) Top

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No subvariety added yet.

Forms (abbr. f.) Top

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No forms added yet.

Germination/Propagation Top

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Begin at 20°C for 6 weeks, cool to 4°C for 6 weeks, then gradually increase to 10°C over 6 weeks. If no germination, the cycle is repeated.

Sow seeds immediately as their viability decreases rapidly, or they best germinate when fresh. If stored, seeds might need temperature cycling and patience to germinate.

Distribution (via POWO/KEW) Top

Legend for the distribution data:

- Doubtful data

- Extinct

- Introduced

- Native

Asia-temperate click to expand
- China
  - China North-central
  - China South-central
  - China Southeast
  - Inner Mongolia
  - Manchuria
- Eastern Asia
  - Japan
  - Korea
- Mongolia
  - Mongolia
- Russian Far East
  - Amur
  - Kamchatka
  - Khabarovsk
  - Kuril Islands
  - Primorye
  - Sakhalin
- Siberia
  - Chita

Links to other databases Top

Suggest others/fix!

Database	ID/link to page
World Flora Online	wfo-0000519124
Tropicos	50053157
KEW	urn:lsid:ipni.org:names:708031-1
The Plant List	kew-2620576
Missouri Botanical Garden	291420
Open Tree Of Life	512693
NCBI Taxonomy	64042
IPNI	708031-1
iNaturalist	742176
GBIF	5616565
EPPO	AATSI
USDA GRIN	411898
Wikipedia	Actaea_simplex
CMAUP	NPO2727

Genomes (via NCBI) Top

No reference genome is available on NCBI yet. We are constantly monitoring for new data.

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

Natural-derived acetophenones: chemistry and pharmacological activities

Ahmadpourmir H, Attar H, Asili J, Soheili V, Taghizadeh SF, Shakeri A

Nat Prod Bioprospect

10-May-2024

PMCID:	PMC11087454
doi:	10.1007/s13659-024-00447-x
PMID:	38727781

Traditional uses, phytochemistry, pharmacology, quality control and clinical studies of Cimicifugae Rhizoma: a comprehensive review

Zhang Q, Wei W, Jin X, Lu J, Chen S, Ogaji OD, Wang S, Du K, Chang Y, Li J

Chin Med

07-May-2024

PMCID:	PMC11075223
doi:	10.1186/s13020-024-00937-7
PMID:	38715120

A multi-center cross-sectional study of Chinese Herbal Medicine-Drug adverse reactions using active surveillance in Singapore’s Traditional Chinese Medicine clinics

Ng CY, Zhao Y, Wang N, Chia KL, Teo CH, Peh W, Yeo P, Zhong LL

Chin Med

07-Mar-2024

PMCID:	PMC10918936
doi:	10.1186/s13020-024-00915-z
PMID:	38454483

A Narrative Review of the Herbal Preparation of Ayurvedic, Traditional Chinese, and Kampō Medicines Applied as Radioprotectors

Ibáñez B, Melero A, Montoro A, Merino-Torres JF, Soriano JM, San Onofre N

Antioxidants (Basel)

17-Jul-2023

PMCID:	PMC10376155
doi:	10.3390/antiox12071437
PMID:	37507975

Comparative study of the effects of the three kinds of Kampo-hozai: Ninjinyoeito, Hochuekkito, and Juzentaihoto on anxious and low sociability behavior using NPY-knockout zebrafish

Kawabe M, Nishida T, Takahashi R, Inui A, Shiozaki K

Front Pharmacol

30-May-2023

PMCID:	PMC10267730
doi:	10.3389/fphar.2023.1168229
PMID:	37324500

Kampo formula hochu-ekki-to (Bu-Zhong-Yi-Qi-Tang, TJ-41) ameliorates muscle atrophy by modulating atrogenes and AMPK in vivo and in vitro

Yakabe M, Hosoi T, Sasakawa H, Akishita M, Ogawa S

BMC Complement Med Ther

28-Dec-2022

PMCID:	PMC9795672
doi:	10.1186/s12906-022-03812-w
PMID:	36578084

Anxiolytic-like effects of hochuekkito in lipopolysaccharide-treated mice involve interleukin-6 inhibition

Ushio S, Wada Y, Nakamura M, Matsumoto D, Hoshika K, Shiromizu S, Iwata N, Esumi S, Kajizono M, Kitamura Y, Sendo T

Front Pharmacol

12-Aug-2022

PMCID:	PMC9411515
doi:	10.3389/fphar.2022.890048
PMID:	36034871

Paving the way towards effective plant-based inhibitors of hyaluronidase and tyrosinase: a critical review on a structure–activity relationship

Gębalski J, Graczyk F, Załuski D

J Enzyme Inhib Med Chem

26-Apr-2022

PMCID:	PMC9045780
doi:	10.1080/14756366.2022.2061966
PMID:	35470749

Benefits of Black Cohosh (Cimicifuga racemosa) for Women Health: An Up-Close and In-Depth Review

Mohapatra S, Iqubal A, Ansari MJ, Jan B, Zahiruddin S, Mirza MA, Ahmad S, Iqbal Z

Pharmaceuticals (Basel)

23-Feb-2022

PMCID:	PMC8953734
doi:	10.3390/ph15030278
PMID:	35337076

Effects of Hochuekkito, a traditional Japanese medicine (Kampo), on reproduction of aging female mice

Vo KC, Sato Y, Kawagoe Y, Kawamura K

Reprod Med Biol

10-Nov-2021

PMCID:	PMC8658873
doi:	10.1002/rmb2.12425
PMID:	34938149

Stagonosporopsis pogostemonis: A Novel Ascomycete Fungus Causing Leaf Spot and Stem Blight on Pogostemon cablin (Lamiaceae) in South China

Dong ZY, Huang YH, Manawasinghe IS, Wanasinghe DN, Liu JW, Shu YX, Zhao MP, Xiang MM, Luo M

Pathogens

27-Aug-2021

PMCID:	PMC8465882
doi:	10.3390/pathogens10091093
PMID:	34578126

Hochuekkito can Prevent the Colonization of Methicillin-Resistant Staphylococcus aureus in Upper Respiratory Tract of Acute Stroke Patients

Kitahara M, Takayama S, Akaishi T, Kikuchi A, Ishii T

Front Pharmacol

28-Jun-2021

PMCID:	PMC8273298
doi:	10.3389/fphar.2021.683171
PMID:	34262453

Antitumor Profile of Carbon-Bridged Steroids (CBS) and Triterpenoids

Dembitsky VM, Gloriozova TA, Poroikov VV

Mar Drugs

03-Jun-2021

PMCID:	PMC8228860
doi:	10.3390/md19060324
PMID:	34205074

Intraspecific convergence of floral size correlates with pollinator size on different mountains: a case study of a bumblebee-pollinated Lamium (Lamiaceae) flowers in Japan

Toji T, Ishimoto N, Egawa S, Nakase Y, Hattori M, Itino T

BMC Ecol Evol

24-Apr-2021

PMCID:	PMC8067403
doi:	10.1186/s12862-021-01796-8
PMID:	33894742

Taxonomy and phylogeny of the Erysiphe lonicerae complex (Helotiales, Erysiphaceae) on Lonicera spp.

Bradshaw M, Braun U, Götz M, Takamatsu S

Fungal Syst Evol

26-Nov-2020

PMCID:	PMC8165964
doi:	10.3114/fuse.2021.07.03
PMID:	34124617

Phytochemical Profile Top

Add a new one!

Below are displayed the proven (via scientific papers) natural compounds!
You can also contribute to this by clicking here.

Name	PubChem ID	Canonical SMILES	MW	Found in	Proof
> Benzenoids / Benzene and substituted derivatives
Benzaldehyde, oxime, (Z)-	5324470	Click to see C1=CC=C(C=C1)C=NO	121.14	unknown	via CMAUP database
Phenylethyl Alcohol	6054	Click to see C1=CC=C(C=C1)CCO	122.16	unknown	https://doi.org/10.1016/0305-1978(87)90058-5
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acid esters
Methyl Benzoate	7150	Click to see	136.15	unknown	https://doi.org/10.1016/0305-1978(87)90058-5
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acid esters / o-Hydroxybenzoic acid esters
Methyl Salicylate	4133	Click to see COC(=O)C1=CC=CC=C1O	152.15	unknown	https://doi.org/10.1016/0305-1978(87)90058-5
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Salicylic acid and derivatives / Salicylic acids
Salicylic Acid	338	Click to see	138.12	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoyl derivatives
Benzaldehyde	240	Click to see	106.12	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzyl alcohols
Benzyl Alcohol	244	Click to see	108.14	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Methoxybenzenes / Dimethoxybenzenes
Methyleugenol	7127	Click to see COC1=C(C=C(C=C1)CC=C)OC	178.23	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Phenyl methylcarbamates
Carbamic acid, methyl-, 3-(dimethylamino)-p-tolyl ester	26479	Click to see	208.26	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Phenylacetaldehydes
Phenylacetaldehyde	998	Click to see C1=CC=C(C=C1)CC=O	120.15	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Phenylpropanes
2-(4-Methylphenyl)propan-2-ol	14529	Click to see CC1=CC=C(C=C1)C(C)(C)O	150.22	unknown	via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Styrenes
Benzene, propenyl-	12500	Click to see CC=CC1=CC=CC=C1	118.18	unknown	https://doi.org/10.1016/0305-1978(87)90058-5
> Benzenoids / Phenanthrenes and derivatives
Phenanthrene	995	Click to see C1=CC=C2C(=C1)C=CC3=CC=CC=C32	178.23	unknown	via CMAUP database
> Benzenoids / Phenol ethers / Anisoles
Anethole	637563	Click to see	148.20	unknown	via CMAUP database
Anethole, (Z)-	1549040	Click to see CC=CC1=CC=C(C=C1)OC	148.20	unknown	via CMAUP database
Elemicin	10248	Click to see	208.25	unknown	via CMAUP database
> Benzenoids / Phenols / 1-hydroxy-4-unsubstituted benzenoids
Hydron phenoxide	20488062	Click to see	94.11	unknown	via CMAUP database
> Benzenoids / Phenols / Cresols / Ortho cresols
O-Cresol	335	Click to see	108.14	unknown	via CMAUP database
> Benzenoids / Phenols / Cresols / Para cresols
P-Cresol	2879	Click to see	108.14	unknown	via CMAUP database
> Benzenoids / Phenols / Methoxyphenols
Eugenol	3314	Click to see	164.20	unknown	via CMAUP database
Guaiacol	460	Click to see	124.14	unknown	via CMAUP database
Isoeugenol	853433	Click to see	164.20	unknown	https://doi.org/10.1016/0305-1978(87)90058-5
> Hydrocarbons / Polycyclic hydrocarbons
Perhydropyrene	75524	Click to see	218.38	unknown	via CMAUP database
> Hydrocarbons / Saturated hydrocarbons / Alkanes
Hexacosane	12407	Click to see CCCCCCCCCCCCCCCCCCCCCCCCCC	366.70	unknown	via CMAUP database
Pentacosane	12406	Click to see	352.70	unknown	via CMAUP database
Pentadecane	12391	Click to see	212.41	unknown	via CMAUP database
Tricosane	12534	Click to see CCCCCCCCCCCCCCCCCCCCCCC	324.60	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters / Fatty acid methyl esters
Methyl Palmitate	8181	Click to see	270.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Branched fatty acids / Methyl-branched fatty acids
3-Methyl crotonic acid	10931	Click to see CC(=CC(=O)O)C	100.12	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids
Myristic Acid	11005	Click to see	228.37	unknown	via CMAUP database
Palmitic Acid	985	Click to see	256.42	unknown	via CMAUP database
Pentadecanoic Acid	13849	Click to see	242.40	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Medium-chain fatty acids
Heptanoic Acid	8094	Click to see	130.18	unknown	via CMAUP database
Hexanoic Acid	8892	Click to see	116.16	unknown	https://doi.org/10.1080/14786410500182037
Lauric Acid	3893	Click to see	200.32	unknown	via CMAUP database
Nonanoic Acid	8158	Click to see CCCCCCCCC(=O)O	158.24	unknown	via CMAUP database
Octanoic Acid	379	Click to see CCCCCCCC(=O)O	144.21	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Straight chain fatty acids
Pentanoic Acid	7991	Click to see	102.13	unknown	via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols
(+)-2-Octanol	2723888	Click to see	130.23	unknown	via CMAUP database
1-Octanol	957	Click to see CCCCCCCCO	130.23	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
(E)-2,6,10-Trimethylundeca-5,9-dienol	6364638	Click to see CC(CCC=C(C)CCC=C(C)C)CO	210.36	unknown	via CMAUP database
beta-Ocimene, (3Z)-	5320250	Click to see	136.23	unknown	https://doi.org/10.1016/0305-1978(87)90058-5
Citral	638011	Click to see	152.23	unknown	via CMAUP database
Geraniol	637566	Click to see CC(=CCCC(=CCO)C)C	154.25	unknown	via CMAUP database
Geranylacetone	1549778	Click to see	194.31	unknown	via CMAUP database
Linalool	6549	Click to see	154.25	unknown	https://doi.org/10.1016/0305-1978(87)90058-5
Linalool, (-)-	443158	Click to see CC(=CCCC(C)(C=C)O)C	154.25	unknown	via CMAUP database
Linalool, (+)-	67179	Click to see	154.25	unknown	via CMAUP database
Neral	643779	Click to see	152.23	unknown	via CMAUP database
Nerol	643820	Click to see CC(=CCCC(=CCO)C)C	154.25	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids
(-)-(1S,4S)-Borneol	6850744	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
(1R,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol	12242824	Click to see	154.25	unknown	via CMAUP database
(1R,5S)-6,6-Dimethylbicyclo[3.1.1]heptan-2-one	10313167	Click to see	138.21	unknown	via CMAUP database
(1S,2S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol	12242815	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
6,6-Dimethylbicyclo[3.1.1]heptan-2-one	32735	Click to see CC1(C2CCC(=O)C1C2)C	138.21	unknown	via CMAUP database
Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, exo-	439569	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
Borneol	64685	Click to see	154.25	unknown	via CMAUP database
Borneol, (-)-	1201518	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
Camphene	6616	Click to see	136.23	unknown	https://doi.org/10.1016/0305-1978(87)90058-5
CID 44630107	44630107	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
D-Borneol	6552009	Click to see	154.25	unknown	via CMAUP database
DL-Borneol	10492	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
Npc189036	10049	Click to see	154.25	unknown	via CMAUP database
Npc308218	439568	Click to see	154.25	unknown	via CMAUP database
Sumatra camphor	657014	Click to see CC1(C2CCC1(C(C2)O)C)C	154.25	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids
(-)-Pulegone	638012	Click to see CC1CCC(=C(C)C)C(=O)C1	152.23	unknown	via CMAUP database
(+) Menthol	12285346	Click to see CC1CCC(C(C1)O)C(C)C	156.26	unknown	via CMAUP database
(+)-Menthol	165675	Click to see CC1CCC(C(C1)O)C(C)C	156.26	unknown	via CMAUP database
(+)-Menthone	443159	Click to see	154.25	unknown	via CMAUP database
(+)-Neomenthol	439263	Click to see	156.26	unknown	via CMAUP database
(L)-alpha-terpineol	443162	Click to see	154.25	unknown	via CMAUP database
Alpha-Terpineol	17100	Click to see	154.25	unknown	via CMAUP database
l-Menthol	16666	Click to see CC1CCC(C(C1)O)C(C)C	156.26	unknown	via CMAUP database
l-Menthyl propionate	221455	Click to see CCC(=O)OC1CC(CCC1C(C)C)C	212.33	unknown	via CMAUP database
Limonene, (+/-)-	22311	Click to see CC1=CCC(CC1)C(=C)C	136.23	unknown	https://doi.org/10.1016/0305-1978(87)90058-5
Menthol	1254	Click to see	156.26	unknown	via CMAUP database
Menthone	26447	Click to see	154.25	unknown	via CMAUP database
p-Menth-4(8)-en-3-one	6988	Click to see CC1CCC(=C(C)C)C(=O)C1	152.23	unknown	via CMAUP database
p-Menthan-3-one	6986	Click to see	154.25	unknown	via CMAUP database
Pulegone	442495	Click to see CC1CCC(=C(C)C)C(=O)C1	152.23	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
(+)-Nerolidol	5356544	Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C	222.37	unknown	via CMAUP database
(1S,2R,3R,7S,12S,17R,18R,19R,22S)-22-(2-Hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24,25-trioxaheptacyclo[19.2.1.19,12.01,18.03,17.04,14.07,12]pentacos-4(14)-en-2-ol	71448948	Click to see	486.70	unknown	via CMAUP database
(1S,2R,3R,7S,9S,12S,17R,18R,19R)-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24,25-trioxaheptacyclo[19.2.1.19,12.01,18.03,17.04,14.07,12]pentacos-4(14)-en-2-ol	101593158	Click to see CC1CC2C(OC3(C1C4(CCC5=C(C4(C3O)C)CCC6C(C7CCC6(C5)O7)(C)C)C)O2)C(C)(C)O	486.70	unknown	via CMAUP database
(1S,6R,7R,8R,12R,14R,18S,20S)-10-(1,2-dihydroxy-2-methylpropyl)-6,8,14,19,19-pentamethyl-11,23-dioxahexacyclo[18.2.1.01,18.03,15.06,14.07,12]tricos-3(15)-en-13-one	101593159	Click to see	486.70	unknown	via CMAUP database
(3R,6E)-Nerolidol	11241545	Click to see	222.37	unknown	via CMAUP database
(3S,6E)-Nerolidol	5281525	Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C	222.37	unknown	via CMAUP database
1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-	8888	Click to see	222.37	unknown	via CMAUP database
1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, (3R,6Z)-	12227246	Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C	222.37	unknown	via CMAUP database
24-O-Acetylacerionol	101596791	Click to see	528.70	unknown	via CMAUP database
6,10,14-Trimethylpentadecan-2-one	10408	Click to see CC(C)CCCC(C)CCCC(C)CCCC(=O)C	268.50	unknown	via CMAUP database
Acerinol	73347277	Click to see	486.70	unknown	via CMAUP database
Caryophyllene	5281515	Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C	204.35	unknown	https://doi.org/10.1016/0305-1978(87)90058-5
Caryophyllene,alpha + beta mixt.	5354499	Click to see	204.35	unknown	https://doi.org/10.1016/0305-1978(87)90058-5
cis-Nerolidol	5320128	Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C	222.37	unknown	via CMAUP database
Humulene	5281520	Click to see	204.35	unknown	https://doi.org/10.1016/0305-1978(87)90058-5
Nerolidol	5284507	Click to see	222.37	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eremophilane, 8,9-secoeremophilane and furoeremophilane sesquiterpenoids
Atractylol	5321065	Click to see CC1=COC2=C1CC3C(=C)CCCC3(C2)C	216.32	unknown	https://doi.org/10.1080/14786410500182037
Atractylon	3080635	Click to see CC1=COC2=C1CC3C(=C)CCCC3(C2)C	216.32	unknown	https://doi.org/10.1080/14786410500182037
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids
2-(4a-Methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)propan-2-ol	521215	Click to see	222.37	unknown	via CMAUP database
Beta-Eudesmol	91457	Click to see	222.37	unknown	via CMAUP database
Npc53720	6432456	Click to see	222.37	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides
Paeoniflorin	442534	Click to see	480.50	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Triterpene glycosides / Triterpene saponins
((2S,3R,4S,5S,6R)-6-(((2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl)oxymethyl)-3,4,5-trihydroxyoxan-2-yl) (1S,2R,4aS,6aR,6aR,6bR,8R,8aR,9R,10R,11R,12aR,14bS)-8,10,11-trihydroxy-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-carboxylate	45356919	Click to see	975.10	unknown	via CMAUP database
(1S,2R,3S,4R,5S,7R,9S,12R,14S,17R,18R,19R,21R,22S)-9-[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosane-2,5-diol	163103126	Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CC(C6C4(C3O)C)O)(C)C)OC8C(C(C(O8)CO)O)O)C)O2)C(C)(C)O	636.80	unknown	https://doi.org/10.1248/CPB.43.1167
(1S,2R,3S,4R,7R,9S,12R,14R,16R,17R,18R,19R,21R,22S)-9-[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosane-2,16-diol	162866555	Click to see	636.80	unknown	https://doi.org/10.1248/CPB.43.1167
(1S,2R,3S,4R,7R,9S,12R,14R,16R,17R,18R,19R,21R,22S)-9-[(2R,3S,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosane-2,16-diol	162866554	Click to see	636.80	unknown	https://doi.org/10.1248/CPB.43.1167
(2R,3R,4S,5R,6R)-2-[[(1S,2R,3R,7R,9S,12R,14R,17R,18R,19R,21R,22S)-2-hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-9-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol	102600397	Click to see	648.80	unknown	https://doi.org/10.1248/CPB.44.2078
(2R,3R,4S,5R,6R)-2-[[(1S,2R,3R,7S,9S,12R,14R,17R,18R,19R,21R,22S)-2-hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-9-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol	162848809	Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CC=C6C4(C3O)C)(C)C)OC8C(C(C(C(O8)CO)O)O)O)C)O2)C(C)(C)O	648.80	unknown	https://doi.org/10.1248/CPB.47.511
[(1R,3R)-1-[(2S)-3,3-dimethyloxiran-2-yl]-3-[(1R,3R,6S,8R,12R,13R,15R,16R)-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl]butyl] acetate	100936538	Click to see	690.90	unknown	https://doi.org/10.1248/CPB.47.511
[(1R)-1-[(1R,4R,5R,6R,8R,10R,11R,12R,16R,18S,21R)-10,11-dihydroxy-4,6,12,17,17-pentamethyl-18-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-en-8-yl]-2-hydroxy-2-methylpropyl] acetate	102600395	Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CC=C5C3(C2O)C)(C)C)OC7C(C(C(C(O7)CO)O)O)O)C)O)C(C(C)(C)O)OC(=O)C	708.90	unknown	https://doi.org/10.1248/CPB.44.2078 https://doi.org/10.1248/CPB.47.511
[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2R,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (1S,2R,4aS,6aR,6aS,6bR,8R,8aR,9R,10R,11R,12aR,14bS)-8,10,11-trihydroxy-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-carboxylate	73415765	Click to see	975.10	unknown	via CMAUP database
[1-(3,3-Dimethyloxiran-2-yl)-3-[13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl]butyl] acetate	85193599	Click to see	690.90	unknown	https://doi.org/10.1248/CPB.47.511
2-[(1S,2R,3S,4R,5S,7R,9S,12R,14S,17R,18R,19R,21R,22S)-9-[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2,5-dihydroxy-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-22-yl]propan-2-yl acetate	162869510	Click to see	678.80	unknown	https://doi.org/10.1248/CPB.43.1167
2-[9-[3,4-Dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2,5-dihydroxy-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-22-yl]propan-2-yl acetate	162869509	Click to see	678.80	unknown	https://doi.org/10.1248/CPB.43.1167
9-[3,4-Dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosane-2,16-diol	162866553	Click to see CC1CC2C(OC3(C1C4(C(CC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(O8)CO)O)O)O)C)O2)C(C)(C)O	636.80	unknown	https://doi.org/10.1248/CPB.43.1167
9-[3,4-Dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosane-2,5-diol	163103125	Click to see	636.80	unknown	https://doi.org/10.1248/CPB.43.1167
Madecassoside	24825675	Click to see	975.10	unknown	via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
Cimicinol	102146755	Click to see CC1CC2C(OC3(C1C4(CC=C5CC6=CCC(C(C6CC=C5C4(C3)C)(C)C)OC7C(C(C(CO7)O)O)O)C)O2)C(C)(C)O	600.80	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Cycloartanols and derivatives
(1R,3R,6S,8R,12R,15R,16R,18S)-15-[(2R,5R)-5,6-dihydroxy-6-methyl-4-oxoheptan-2-yl]-18-hydroxy-7,7,12,16-tetramethyl-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxypentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-en-14-one	24721385	Click to see CC(CC(=O)C(C(C)(C)O)O)C1C(=O)CC2(C1(CC(C34C2=CCC5C3(C4)CCC(C5(C)C)OC6C(C(C(CO6)O)O)O)O)C)C	634.80	unknown	via CMAUP database
(1S,2S,3S,4R,7R,9S,12R,14S,17R,18R,19R,21R,22R)-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosane-2,9-diol	101596828	Click to see	488.70	unknown	via CMAUP database
(1S,3R,6S,8R,12R,15R,16R,18S)-15-[(2R)-4-[(2R)-3,3-dimethyloxiran-2-yl]-4-oxobutan-2-yl]-6,18-dihydroxy-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-en-14-one	10413064	Click to see CC(CC(=O)C1C(O1)(C)C)C2C(=O)CC3(C2(CC(C45C3=CCC6C4(C5)CCC(C6(C)C)O)O)C)C	484.70	unknown	via CMAUP database
(23R,24S)-3beta-(beta-D-Xylopyranosyloxy)-9beta,19-cyclo-16beta,23-epoxy-5alpha-lanost-7-ene-15alpha,16,24,25-tetraol 24-acetate	100936497	Click to see	678.80	unknown	https://doi.org/10.1248/CPB.47.511
(2S,3R,4S,5R)-2-[(1'R,4'R,12'R,16'R,21'R)-2-hydroxy-1,4',6',12',17',17'-hexamethylspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-ene]-18'-yl]oxyoxane-3,4,5-triol	54750570	Click to see	616.80	unknown	via CMAUP database
(2S,3R,4S,5R)-2-[(1S,1'S,4R,4'R,5R,5'R,6'R,10'S,12'R,16'S,18'S,20'S,21'S)-2,20'-dihydroxy-1,4',6',12',17',17'-hexamethylspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-ene]-18'-yl]oxyoxane-3,4,5-triol	102120220	Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(CCC67CC68C(CC=C7C5(C4)C)C(C(CC8O)OC9C(C(C(CO9)O)O)O)(C)C)C	632.80	unknown	https://doi.org/10.1248/CPB.46.1001
(2S,3R,4S,5R)-2-[(1S,1'S,4R,4'R,5R,5'R,6'R,10'S,12'S,13'S,16'S,18'S,20'S,21'S)-2,20'-dihydroxy-1,4',6',12',17',17'-hexamethylspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosane]-18'-yl]oxyoxane-3,4,5-triol	102120221	Click to see	634.80	unknown	https://doi.org/10.1248/CPB.46.1001
(2S,3R,4S,5R)-2-[[(1S,2R,3R,7S,9S,12R,14R,17R,18R,19R,21R,22S)-2-hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-9-yl]oxy]oxane-3,4,5-triol	162976747	Click to see	618.80	unknown	https://doi.org/10.1248/CPB.47.511
(2S,3R,4S,5R)-2-[[(1S,2S,3R,7S,9S,12R,14R,17R,18R,19R,21R,22R)-2-hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-9-yl]oxy]oxane-3,4,5-triol	162976752	Click to see	618.80	unknown	https://doi.org/10.1248/CPB.47.511
(2S,3R,4S,5R)-2-[[(1S,2S,5R,7S,10R,12S,15R,16R,17S,18R,21R,22R,24S)-21,22-dihydroxy-1,6,6,15,17,20,20-heptamethyl-19,23-dioxaheptacyclo[13.10.0.02,12.05,10.010,12.016,24.018,22]pentacosan-7-yl]oxy]oxane-3,4,5-triol	21591252	Click to see	620.80	unknown	https://doi.org/10.1016/S0031-9422(98)00407-5
(2S,3R,4S,5R)-2-[[(1S,2S,5R,7S,10R,12S,15R,16R,17S,18R,21R,22S,24S)-21,22-dihydroxy-1,6,6,15,17,20,20-heptamethyl-19,23-dioxaheptacyclo[13.10.0.02,12.05,10.010,12.016,24.018,22]pentacosan-7-yl]oxy]oxane-3,4,5-triol	101943862	Click to see	620.80	unknown	https://doi.org/10.3987/COM-98-8121
(2S,3R,4S,5R)-2-{[(4aR,5'R,5aS,7aR,7bR,10S,11aS,12aS,12bS,14aR)-4'-hydroxy-1,1,5',7a,8,12a-hexamethylhexadecahydro-2H-spiro[cyclopropa[1',8a']naphtho[2',1':4,5]indeno[2,1-b]pyran-10,2'-[3,6]dioxabicyclo[3.1.0]hexan]-2-yl]oxy}tetrahydro-2H-pyran-3,4,5-trio	6537491	Click to see	618.80	unknown	https://doi.org/10.1248/CPB.43.771
(2S,3R,4S,5R)-2-{[(4aR,5aR,7aR,8R,12aR,14aR)-4'-hydroxy-1,1,5',7a,8,12a-hexamethyl-1,3,4,6,7,7a,7b,8,9,11a,12,12a,14,14a-tetradecahydro-2H-spiro[cyclopropa[1',8a']naphtho[2',1':4,5]indeno[2,1-b]pyran-10,2'-[3,6]dioxabicyclo[3.1.0]hexan]-2-yl]oxy}tetrahydr	6537499	Click to see	616.80	unknown	https://doi.org/10.1248/CPB.46.467 https://doi.org/10.1248/YAKUSHI1947.103.3_293
(2S,3R,4S,5S)-2-[[(1S,2R,3R,7S,9S,12R,14R,17R,18R,19R,21R,22S)-2-hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-9-yl]oxy]oxane-3,4,5-triol	163186526	Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CC=C6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)O)O)C)O2)C(C)(C)O	618.80	unknown	https://doi.org/10.1248/CPB.47.511
(2S,3R,4S,5S)-2-[[(1S,2R,3S,7R,9S,12R,14S,16R,17R,18R,19R,21R,22S)-2,16-dihydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-9-yl]oxy]oxane-3,4,5-triol	162842895	Click to see CC1CC2C(OC3(C1C4(C(CC56CC57CCC(C(C7CC=C6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)O)O)O)C)O2)C(C)(C)O	634.80	unknown	https://doi.org/10.1248/CPB.49.437 https://doi.org/10.1248/BPB.24.1198
(2S,3R,4S,5S)-2-[[(2R,3S,7R,9S,12R,14S,16R,17R,18R,19R,21R,22S)-2,16-dihydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-9-yl]oxy]oxane-3,4,5-triol	101096469	Click to see	634.80	unknown	https://doi.org/10.1248/CPB.49.437
(3R,6S,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-6-methylhept-5-en-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol	145925700	Click to see	426.70	unknown	https://doi.org/10.1248/CPB.47.1157
[(1'R,3'R,4'R,5'R,6'R,10'S,12'S,16'R,18'S,21'R)-2-Hydroxy-1,4',6',12',17',17'-hexamethyl-18'-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-ene]-3'-yl] acetate	24721455	Click to see	674.80	unknown	via CMAUP database
[(1'R,3'R,4'R,5'R,6'R,12'S,13'S,16'R,18'S,21'R)-1,4',6',12',17',17'-hexamethyl-18'-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosane]-3'-yl] acetate	101081787	Click to see CC1CC2(C3C(O3)(CO2)C)OC4C1C5(C(CC67CC68CCC(C(C8CCC7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C	660.80	unknown	via CMAUP database
[(1'R,3'R,4'R,5'R,6'R,12'S,13'S,16'R,18'S,21'R)-18'-[(2S,3R,4S,5R)-3-acetyloxy-4,5-dihydroxyoxan-2-yl]oxy-2-hydroxy-1,4',6',12',17',17'-hexamethylspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosane]-3'-yl] acetate	101110571	Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(C(CC67CC68CCC(C(C8CCC7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)OC(=O)C)OC(=O)C)C	718.90	unknown	via CMAUP database
[(1R,1'S,4S,4'R,5R,5'R,6'R,10'S,12'R,16'S,18'S,20'R,21'S)-1,4',6',12',17',17'-hexamethyl-18'-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-ene]-20'-yl] acetate	163006957	Click to see	658.80	unknown	https://doi.org/10.1248/CPB.47.511
[(1R,3R)-1-[(2R)-3,3-dimethyloxiran-2-yl]-3-[(1S,3R,6S,8R,11R,12S,13R,15R,16R)-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]butyl] acetate	53326834	Click to see	662.80	unknown	https://doi.org/10.1248/CPB.42.1940
[(1R,3R)-1-[(2S)-3,3-dimethyloxiran-2-yl]-3-[(1R,3R,6S,8R,12R,13R,15R,16R)-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl]butyl] acetate	102179089	Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)C)C)O	660.80	unknown	https://doi.org/10.1248/CPB.47.1175
[(1R,3R)-3-[(1S,3R,6S,8R,10S,11R,12S,13R,15R,16R)-10,13-dihydroxy-7,7,12,16-tetramethyl-14-oxo-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-1-[(2S)-3,3-dimethyloxiran-2-yl]butyl] acetate	163010237	Click to see	678.80	unknown	https://doi.org/10.1248/CPB.42.1106
[(1R,3R)-3-[(1S,3R,6S,8R,11R,12S,13R,15R,16R)-6-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-1-[(2R)-3,3-dimethyloxiran-2-yl]butyl] acetate	10440478	Click to see	825.00	unknown	https://doi.org/10.1248/CPB.42.1940
[(1R,3R)-3-[(1S,3S,4S,6S,8S,11R,12S,13R,15R,16R)-4,13-dihydroxy-7,7,12,16-tetramethyl-14-oxo-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-1-[(2R)-3,3-dimethyloxiran-2-yl]butyl] acetate	163186918	Click to see	678.80	unknown	https://doi.org/10.1248/CPB.43.279
[(1R)-1-[(1R,4R,5R,6R,8R,10R,11R,12R,16R,18S,21R)-10,11-dihydroxy-4,6,12,17,17-pentamethyl-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-en-8-yl]-2-hydroxy-2-methylpropyl] acetate	100936502	Click to see	678.80	unknown	https://doi.org/10.1248/CPB.47.511
[(1R)-1-[(1R,4R,5R,6R,8R,10R,11R,12R,16R,18S,21R)-10,11-dihydroxy-4,6,12,17,17-pentamethyl-18-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-en-8-yl]-2-hydroxy-2-methylpropyl] acetate	100936496	Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CC=C5C3(C2O)C)(C)C)OC7C(C(C(CO7)O)O)O)C)O)C(C(C)(C)O)OC(=O)C	678.80	unknown	https://doi.org/10.1248/CPB.47.511
[(1S,1'R,2S,3'R,4R,4'R,5S,5'R,6'R,10'S,12'S,13'S,16'R,18'S,21'R)-2-hydroxy-1,4',6',12',17',17'-hexamethyl-18'-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosane]-3'-yl] acetate	53325243	Click to see CC1CC2(C3C(O3)(C(O2)O)C)OC4C1C5(C(CC67CC68CCC(C(C8CCC7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C	676.80	unknown	via CMAUP database
[(1S,1'R,3'R,4R,4'R,5S,5'R,6'R,12'S,13'S,16'R,18'S,21'R)-1,4',6',12',17',17'-hexamethyl-18'-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosane]-3'-yl] acetate	101182169	Click to see	660.80	unknown	via CMAUP database
[(1S,1'R,4R,4'R,5'R,10'S,12'S,13'S,16'R,21'R)-2-hydroxy-1,4',6',12',17',17'-hexamethyl-18'-[(2S)-3,4,5-trihydroxyoxan-2-yl]oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosane]-3'-yl] acetate	137705962	Click to see	676.80	unknown	https://doi.org/10.1248/CPB.43.771
[(1S,1'S,2R,3'R,4R,4'R,5R,5'R,6'R,10'S,12'S,18'S,21'R)-2-methoxy-1,4',6',12',17',17'-hexamethyl-18'-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-ene]-3'-yl] acetate	10818396	Click to see CC1CC2(C3C(O3)(C(O2)OC)C)OC4C1C5(C(CC67CC68CCC(C(C8CC=C7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C	688.80	unknown	via CMAUP database
[(1S,1'S,2S,3'R,4R,4'R,5R,5'R,6'R,10'S,12'S,16'R,18'S,21'R)-2-hydroxy-1,4',6',12',17',17'-hexamethyl-18'-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-ene]-3'-yl] acetate	102004880	Click to see	674.80	unknown	via CMAUP database
[(1S,1'S,3'R,4'R,5R,5'R,6'R,10'S,12'S,16'R,18'S,21'R)-2-hydroxy-1,4',6',12',17',17'-hexamethyl-18'-(3,4,5-trihydroxyoxan-2-yl)oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-ene]-3'-yl] acetate	399179	Click to see	674.80	unknown	via CMAUP database
[(1S,3'S,4R,4'R,5R,5'R,6'R,10'S,12'S,16'R,18'R,21'R)-2-hydroxy-1,4',6',12',17',17'-hexamethyl-18'-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-ene]-3'-yl] acetate	139035030	Click to see	674.80	unknown	https://doi.org/10.1248/CPB.46.467 https://doi.org/10.1248/YAKUSHI1947.103.3_293
[(1S,3R,6R,8R,12S,13R,15R,16R,17R)-15-[(2R,5R)-5,6-dihydroxy-6-methyl-4-oxoheptan-2-yl]-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-17-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl] acetate	162908290	Click to see	692.80	unknown	https://doi.org/10.1248/BPB.24.1198
[(1S,3R,6R,8R,12S,13R,15R,16R,17R)-15-[(2R)-4-[(2R)-3,3-dimethyloxiran-2-yl]-4-oxobutan-2-yl]-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-17-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl] acetate	162843797	Click to see	674.80	unknown	https://doi.org/10.1248/BPB.24.1198
[(1S,3R,6S,8R,12S,13R,15R,16R,17R)-15-[(2R,5R)-5,6-dihydroxy-6-methyl-4-oxoheptan-2-yl]-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-17-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl] acetate	15894670	Click to see CC(CC(=O)C(C(C)(C)O)O)C1C(=O)C(C2(C1(C(CC34C2=CCC5C3(C4)CCC(C5(C)C)OC6C(C(C(CO6)O)O)O)OC(=O)C)C)C)O	692.80	unknown	https://doi.org/10.1248/CPB.49.437
[(1S,3R,6S,8R,12S,13R,15R,16R,17R)-15-[(2R)-4-[(2R)-3,3-dimethyloxiran-2-yl]-4-oxobutan-2-yl]-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-17-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl] acetate	15894671	Click to see	674.80	unknown	https://doi.org/10.1248/CPB.49.437
[(1S,3R,6S,8R,12S,15R,16R,17R)-15-[(2R)-4-[(2S)-3,3-dimethyloxiran-2-yl]-4-oxobutan-2-yl]-7,7,12,16-tetramethyl-14-oxo-6-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-17-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl] acetate	162968489	Click to see	658.80	unknown	https://doi.org/10.1248/BPB.24.1198
[(1S)-1-[(1R,4R,5R,6R,8R,10R,11R,12R,16R,18S,21R)-10,11-dihydroxy-4,6,12,17,17-pentamethyl-18-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-en-8-yl]-2-hydroxy-2-methylpropyl] acetate	100936499	Click to see	678.80	unknown	https://doi.org/10.1248/CPB.47.511
[(1S)-1-[(1R,4R,5R,6R,8S,10R,11R,12R,16S,18S,21R)-10,11-dihydroxy-4,6,12,17,17-pentamethyl-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-en-8-yl]-2-methoxy-2-methylpropyl] acetate	162919959	Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CC=C5C3(C2O)C)(C)C)OC7C(C(C(CO7)O)O)O)C)O)C(C(C)(C)OC)OC(=O)C	692.90	unknown	https://doi.org/10.1248/CPB.47.1175
[1-(3,3-Dimethyloxiran-2-yl)-3-[13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-(3,4,5-trihydroxyoxan-2-yl)oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl]butyl] acetate	85174914	Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)C)C)O	660.80	unknown	https://doi.org/10.1248/CPB.44.2078 https://doi.org/10.1248/CPB.47.1175
[1-[10,11-Dihydroxy-4,6,12,17,17-pentamethyl-18-(3,4,5-trihydroxyoxan-2-yl)oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-en-8-yl]-2-hydroxy-2-methylpropyl] acetate	75111071	Click to see	678.80	unknown	https://doi.org/10.1248/CPB.47.511
[1-[10,11-Dihydroxy-4,6,12,17,17-pentamethyl-18-(3,4,5-trihydroxyoxan-2-yl)oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-en-8-yl]-2-methoxy-2-methylpropyl] acetate	85278634	Click to see	692.90	unknown	https://doi.org/10.1248/CPB.47.1175
[1,4',6',12',17',17'-Hexamethyl-18'-(3,4,5-trihydroxyoxan-2-yl)oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-ene]-20'-yl] acetate	163006956	Click to see CC1CC2(C3C(O3)(CO2)C)OC4C1C5(CCC67CC68C(CC=C7C5(C4)C)C(C(CC8OC(=O)C)OC9C(C(C(CO9)O)O)O)(C)C)C	658.80	unknown	https://doi.org/10.1248/CPB.47.511
[1,4',6',12',17',17'-Hexamethyl-18'-(3,4,5-trihydroxyoxan-2-yl)oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosane]-3'-yl] acetate	73079472	Click to see CC1CC2(C3C(O3)(CO2)C)OC4C1C5(C(CC67CC68CCC(C(C8CCC7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C	660.80	unknown	via CMAUP database
[15-(5,6-Dihydroxy-6-methyl-4-oxoheptan-2-yl)-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-(3,4,5-trihydroxyoxan-2-yl)oxy-17-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl] acetate	85229043	Click to see	692.80	unknown	https://doi.org/10.1248/CPB.49.437
[15-[4-(3,3-Dimethyloxiran-2-yl)-4-oxobutan-2-yl]-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-(3,4,5-trihydroxyoxan-2-yl)oxy-17-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl] acetate	85165371	Click to see CC(CC(=O)C1C(O1)(C)C)C2C(=O)C(C3(C2(C(CC45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)OC(=O)C)C)C)O	674.80	unknown	https://doi.org/10.1248/CPB.49.437
[15-[4-(3,3-Dimethyloxiran-2-yl)-4-oxobutan-2-yl]-7,7,12,16-tetramethyl-14-oxo-6-(3,4,5-trihydroxyoxan-2-yl)oxy-17-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl] acetate	162968484	Click to see CC(CC(=O)C1C(O1)(C)C)C2C(=O)CC3(C2(C(CC45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)OC(=O)C)C)C	658.80	unknown	https://doi.org/10.1248/CPB.49.437
[3-[10,13-Dihydroxy-7,7,12,16-tetramethyl-14-oxo-6-(3,4,5-trihydroxyoxan-2-yl)oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-1-(3,3-dimethyloxiran-2-yl)butyl] acetate	85084053	Click to see	678.80	unknown	https://doi.org/10.1248/CPB.42.1106
[3-[4,13-Dihydroxy-7,7,12,16-tetramethyl-14-oxo-6-(3,4,5-trihydroxyoxan-2-yl)oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-1-(3,3-dimethyloxiran-2-yl)butyl] acetate	85084052	Click to see	678.80	unknown	https://doi.org/10.1248/CPB.43.279
[3-[6-[3,5-Dihydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-1-(3,3-dimethyloxiran-2-yl)butyl] acetate	85143964	Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)OC8C(C(C(C(O8)CO)O)O)O)O)C)C)O	825.00	unknown	https://doi.org/10.1248/CPB.42.1940
11-(2-Hydroxypropan-2-yl)-1,1,7a,8,13a-pentamethyloctadecahydro-5H-10,12a-epoxycyclopropa[1',8'a]naphtho[2',1':4,5]indeno[2,1-b]oxepine-2,13-diol	6453550	Click to see	488.70	unknown	via CMAUP database
11-(2-Hydroxypropan-2-yl)-1,1,7a,8,13a-pentamethyloctadecahydro-5H-10,12a-epoxycyclopropa[1',8a']naphtho[2',1':4,5]indeno[2,1-b]oxepine-2,13-diol	23504335	Click to see	488.70	unknown	via CMAUP database
2-[(1S,2S,3R,7S,9S,12R,14R,17R,18R,19R,21R,22S)-2-hydroxy-3,8,8,17,19-pentamethyl-9-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-22-yl]propan-2-yl acetate	163080943	Click to see	660.80	unknown	https://doi.org/10.1248/CPB.47.511
2-[(1S,2S,3R,7S,9S,12R,14R,17R,18R,19R,21R,22S)-2-hydroxy-3,8,8,17,19-pentamethyl-9-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-22-yl]propan-2-yl acetate	163080945	Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CC=C6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)O)O)C)O2)C(C)(C)OC(=O)C	660.80	unknown	https://doi.org/10.1248/CPB.47.511
2-[[(1S,5R,7S,10R,12S,15R,16R,17S,18R,21R,22R,24S)-21,22-dihydroxy-1,6,6,15,17,20,20-heptamethyl-19,23-dioxaheptacyclo[13.10.0.02,12.05,10.010,12.016,24.018,22]pentacosan-7-yl]oxy]oxane-3,4,5-triol	398801	Click to see	620.80	unknown	via CMAUP database
2-[[2-Hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-9-yl]oxy]oxane-3,4,5-triol	75111211	Click to see	618.80	unknown	https://doi.org/10.1248/CPB.47.511
2-[[2,16-Dihydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-9-yl]oxy]oxane-3,4,5-triol	73239319	Click to see	634.80	unknown	https://doi.org/10.1248/CPB.49.437
2-[2-Hydroxy-3,8,8,17,19-pentamethyl-9-(3,4,5-trihydroxyoxan-2-yl)oxy-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-22-yl]propan-2-yl acetate	75111212	Click to see	660.80	unknown	https://doi.org/10.1248/CPB.47.511
2'-O-Acetylactein	21592425	Click to see	718.90	unknown	via CMAUP database
23-EPI-26-Deoxyactein	21668683	Click to see	660.80	unknown	via CMAUP database
23-O-Acetyl shengmanol xyloside	13071462	Click to see	662.80	unknown	https://doi.org/10.1248/CPB.42.1940
23-O-acetyl-7,8-didehydroshengmanol-3-O-alpha-l-arabinopyranoside	15786366	Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)C)C)O	660.80	unknown	https://doi.org/10.1248/CPB.44.2078
24-Methylene-9beta,19-cyclo-lanostan-3beta-ol	9547213	Click to see	440.70	unknown	https://doi.org/10.1248/CPB.47.1157
24-Methylenecycloartanol	94204	Click to see	440.70	unknown	https://doi.org/10.1248/CPB.47.1157
26-Deoxyactein	10974362	Click to see CC1CC2(C3C(O3)(CO2)C)OC4C1C5(C(CC67CC68CCC(C(C8CCC7C5(C4)C)(C)C)OC9C(C(C(CO9)O)O)O)OC(=O)C)C	660.80	unknown	via CMAUP database
26-Deoxycimicifugoside	72941763	Click to see	658.80	unknown	via CMAUP database
3-[(2S,3R,4S,5R)-2-[[(1R,3R,6S,8R,12R,13R,15R,16R)-15-[(2R,4R)-4-acetyloxy-4-[(2S)-3,3-dimethyloxiran-2-yl]butan-2-yl]-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl]oxy]-4,5-dihydroxyoxan-3-yl]oxy-3-oxopropanoic acid	162962838	Click to see CC(CC(C1C(O1)(C)C)OC(=O)C)C2C(=O)C(C3(C2(CCC45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)OC(=O)CC(=O)O)C)C)O	746.90	unknown	https://doi.org/10.1248/CPB.47.1175
3-[(2S,3R,4S,5R)-2-[[(1R,4R,5R,6R,8R,10R,11R,12R,16R,18S,21R)-8-[(1R)-1-acetyloxy-2-hydroxy-2-methylpropyl]-10,11-dihydroxy-4,6,12,17,17-pentamethyl-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-en-18-yl]oxy]-4,5-dihydroxyoxan-3-yl]oxy-3-oxopropanoic acid	162939495	Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CC=C5C3(C2O)C)(C)C)OC7C(C(C(CO7)O)O)OC(=O)CC(=O)O)C)O)C(C(C)(C)O)OC(=O)C	764.90	unknown	https://doi.org/10.1248/CPB.47.1175
3-[(2S,3R,4S,5R)-2-[[(1S,2R,5S,7S,10R,12S,15R,16R,17S,18R,21R,22R,24S)-21,22-dihydroxy-1,6,6,15,17,20,20-heptamethyl-19,23-dioxaheptacyclo[13.10.0.02,12.05,10.010,12.016,24.018,22]pentacosan-7-yl]oxy]-4,5-dihydroxyoxan-3-yl]oxy-3-oxopropanoic acid	163008472	Click to see	706.90	unknown	https://doi.org/10.1248/CPB.47.1175
3-[(2S,3R,4S,5R)-2-[[(1S,3R,6S,8R,11S,12S,13R,15R,16R)-15-[(2R,4R)-4-acetyloxy-4-[(2S)-3,3-dimethyloxiran-2-yl]butan-2-yl]-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]-4,5-dihydroxyoxan-3-yl]oxy-3-oxopropanoic acid	163041489	Click to see	748.90	unknown	https://doi.org/10.1248/CPB.47.1175
3-[2-[(21,22-Dihydroxy-1,6,6,15,17,20,20-heptamethyl-19,23-dioxaheptacyclo[13.10.0.02,12.05,10.010,12.016,24.018,22]pentacosan-7-yl)oxy]-4,5-dihydroxyoxan-3-yl]oxy-3-oxopropanoic acid	85246060	Click to see CC1C2C(CC3(C2(CCC45C3CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)OC(=O)CC(=O)O)C)C)OC8(C1OC(C8O)(C)C)O	706.90	unknown	https://doi.org/10.1248/CPB.47.1175
3-[2-[[15-[4-Acetyloxy-4-(3,3-dimethyloxiran-2-yl)butan-2-yl]-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl]oxy]-4,5-dihydroxyoxan-3-yl]oxy-3-oxopropanoic acid	85254505	Click to see	746.90	unknown	https://doi.org/10.1248/CPB.47.1175
3-[2-[[15-[4-Acetyloxy-4-(3,3-dimethyloxiran-2-yl)butan-2-yl]-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]-4,5-dihydroxyoxan-3-yl]oxy-3-oxopropanoic acid	85262765	Click to see	748.90	unknown	https://doi.org/10.1248/CPB.47.1175
3-[2-[[8-(1-Acetyloxy-2-hydroxy-2-methylpropyl)-10,11-dihydroxy-4,6,12,17,17-pentamethyl-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-en-18-yl]oxy]-4,5-dihydroxyoxan-3-yl]oxy-3-oxopropanoic acid	85211935	Click to see	764.90	unknown	https://doi.org/10.1248/CPB.47.1175
7,7,12,16-Tetramethyl-15-(6-methylhept-5-en-2-yl)pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-en-6-ol	14137684	Click to see CC(CCC=C(C)C)C1CCC2(C1(CCC34C2=CCC5C3(C4)CCC(C5(C)C)O)C)C	424.70	unknown	https://doi.org/10.1248/YAKUSHI1947.90.1_64
7,8-Didehydrocimigenol	101577840	Click to see	486.70	unknown	via CMAUP database
Actein	10032468	Click to see	676.80	unknown	via CMAUP database
Bugbanoside E	15894672	Click to see CC(CC(=O)C1C(O1)(C)C)C2C(=O)CC3(C2(C(CC45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)OC(=O)C)C)C	658.80	unknown	https://doi.org/10.1248/CPB.49.437
CID 20054872	20054872	Click to see	488.70	unknown	via CMAUP database
CID 21594792	21594792	Click to see	676.80	unknown	via CMAUP database
CID 45934454	45934454	Click to see CC(CC(=O)C1C(O1)(C)C)C2C(=O)CC3(C2(CC(C45C3=CCC6C4(C5)CCC(C6(C)C)OC7C(C(C(CO7)O)O)O)O)C)C	616.80	unknown	https://doi.org/10.1248/CPB.42.2205
CID 51346124	51346124	Click to see	488.70	unknown	via CMAUP database
CID 5319557	5319557	Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)O)C)O2)C(C)(C)OC	502.70	unknown	via CMAUP database
CID 71448947	71448947	Click to see CC1CC(OC2C1C3(CCC45CC46CCC(C(C6CCC5C3(C2=O)C)(C)C)O)C)C(C(C)(C)O)O	488.70	unknown	via CMAUP database
Cimicifugenol	44423584	Click to see	424.70	unknown	https://doi.org/10.1248/CPB.47.1157
Cimicifugoside	441913	Click to see	674.80	unknown	via CMAUP database
Cimicifugoside H-2	10100589	Click to see	634.80	unknown	https://doi.org/10.1248/CPB.43.771
Cimicifugoside H1	15241163	Click to see	616.80	unknown	https://doi.org/10.1248/CPB.42.2205 https://doi.org/10.1248/CPB.43.771
Cimigenol	16020000	Click to see	488.70	unknown	via CMAUP database
Cimiracemoside I	21591917	Click to see	600.80	unknown	via CMAUP database
Cycloartenol	92110	Click to see CC(CCC=C(C)C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C	426.70	unknown	https://doi.org/10.1248/CPB.47.1157
Npc49150	128327	Click to see	674.80	unknown	via CMAUP database
Shengmating	24764419	Click to see	676.80	unknown	via CMAUP database
Shengmating; Spiro[5H-cyclopropa[1',8'a]naphth[2',1':4,5]indeno[2,1-b]pyran-10(2H),2'-[3,6]dioxabicyclo[3.1.0]hexane] \|A-D-xylopyranoside deriv	15558324	Click to see	676.80	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids / Ergosterols and derivatives
delta7-Campesterol	5283646	Click to see	400.70	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Hydroxysteroids
(2S,3R,4S,5R)-2-[[(1R,9S,12R,14S,17R,22S)-2-hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17-tetramethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]oxane-3,4,5-triol	6324926	Click to see	606.80	unknown	via CMAUP database
2-[(9S,12R,14R,17R,22S)-2-hydroxy-3,8,8,17-tetramethyl-9-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-22-yl]propan-2-yl acetate	6324872	Click to see	646.80	unknown	via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal glycosides
18-Hydroxy-15-(5-hydroxy-4-oxopentan-2-yl)-7,7,12,16-tetramethyl-6-(3,4,5-trihydroxyoxan-2-yl)oxypentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-en-14-one	163047785	Click to see	576.70	unknown	https://doi.org/10.1248/CPB.42.2205
2,9,10-Trihydroxy-4,6,12,17,17-pentamethyl-18-(3,4,5-trihydroxyoxan-2-yl)oxyhexacyclo[11.9.0.01,21.04,12.05,10.016,21]docos-13-en-8-one	85090709	Click to see	576.70	unknown	https://doi.org/10.1248/CPB.42.2205
Cimicifugoside H-3	15241164	Click to see	576.70	unknown	https://doi.org/10.1248/CPB.42.2205
Cimicifugoside H-4	10008346	Click to see	576.70	unknown	https://doi.org/10.1248/CPB.42.2205
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal glycosides / Steroidal saponins / Cucurbitacin glycosides
(2R,3R,4S,5R,6R)-2-[[(1S,2R,3S,4R,7R,9S,12R,14S,17R,18R,19R,21R,22S)-2-hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol	102600398	Click to see	650.80	unknown	https://doi.org/10.1248/CPB.44.2078 https://doi.org/10.1248/CPB.47.511
(2R,3R,4S,5R,6R)-2-[[(1S,2R,3S,4R,7R,9S,12R,14S,17R,18R,19R,21R,22S)-2-hydroxy-22-(2-methoxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol	102600399	Click to see	664.90	unknown	https://doi.org/10.1248/CPB.44.2078
(2R,3R,4S,5R,6R)-2-[[(1S,2R,3S,4S,7S,9S,11S,12S,14S,17R,18R,19R,21R,22S)-2,11-dihydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol	162901820	Click to see	666.80	unknown	https://doi.org/10.1248/CPB.47.511
(2R,3R,4S,5S)-2-[[(1S,2R,3S,9S,17R,19R,22R)-2-hydroxy-22-(2-methoxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]oxane-3,4,5-triol	11856241	Click to see	634.80	unknown	via CMAUP database
(2S,3R,4S,5S)-2-[[(1S,2S,3S,4S,7S,9S,11S,12S,14S,17R,18R,19R,21R,22S)-2,11-dihydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]oxane-3,4,5-triol	162897218	Click to see CC1CC2C(OC3(C1C4(CCC56CC57C(CCC6C4(C3O)C)C(C(CC7O)OC8C(C(C(CO8)O)O)O)(C)C)C)O2)C(C)(C)O	636.80	unknown	https://doi.org/10.1248/CPB.47.511
[(1R)-1-[(1S,4R,5R,6R,8R,10R,11R,12S,13R,16R,18S,21R)-10,11-dihydroxy-4,6,12,17,17-pentamethyl-18-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]-2-hydroxy-2-methylpropyl] acetate	102600396	Click to see	710.90	unknown	https://doi.org/10.1248/CPB.44.2078 https://doi.org/10.1248/CPB.47.511
[(1R)-2-hydroxy-2-methyl-1-[(1S,4R,5R,6R,8R,10R,11R,12S,13R,14S,16R,18S,21R)-10,11,14-trihydroxy-4,6,12,17,17-pentamethyl-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]propyl] acetate	163005216	Click to see	696.90	unknown	https://doi.org/10.1248/CPB.44.2078
[(1S)-1-[(1S,4R,5R,6R,8R,10R,11R,12S,13R,16R,18S,21R)-10,11-dihydroxy-4,6,12,17,17-pentamethyl-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]-2-methoxy-2-methylpropyl] acetate	162915170	Click to see	694.90	unknown	https://doi.org/10.1248/CPB.44.2078
[(1S)-2-methoxy-2-methyl-1-[(1S,4R,5R,6R,8R,10R,11R,12S,13R,14S,16R,18S,21R)-10,11,14-trihydroxy-4,6,12,17,17-pentamethyl-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]propyl] acetate	162961032	Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CC(C5C3(C2O)C)O)(C)C)OC7C(C(C(CO7)O)O)O)C)O)C(C(C)(C)OC)OC(=O)C	710.90	unknown	https://doi.org/10.1248/CPB.44.2078
[(1S)-2-methoxy-2-methyl-1-[(1S,4R,5R,6R,8R,10S,11R,12S,13R,16S,18S,20S,21S)-10,11,20-trihydroxy-4,6,12,17,17-pentamethyl-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]propyl] acetate	162942837	Click to see CC1CC(OC2(C1C3(CCC45CC46C(CCC5C3(C2O)C)C(C(CC6O)OC7C(C(C(CO7)O)O)O)(C)C)C)O)C(C(C)(C)OC)OC(=O)C	710.90	unknown	https://doi.org/10.1248/CPB.44.2078
[1-[10,11-Dihydroxy-4,6,12,17,17-pentamethyl-18-(3,4,5-trihydroxyoxan-2-yl)oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]-2-methoxy-2-methylpropyl] acetate	85286528	Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CCC5C3(C2O)C)(C)C)OC7C(C(C(CO7)O)O)O)C)O)C(C(C)(C)OC)OC(=O)C	694.90	unknown	https://doi.org/10.1248/CPB.44.2078
[1-[10,11-Dihydroxy-4,6,12,17,17-pentamethyl-18-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]-2-hydroxy-2-methylpropyl] acetate	85229121	Click to see	710.90	unknown	https://doi.org/10.1248/CPB.44.2078 https://doi.org/10.1248/CPB.47.511
[2-Hydroxy-2-methyl-1-[10,11,14-trihydroxy-4,6,12,17,17-pentamethyl-18-(3,4,5-trihydroxyoxan-2-yl)oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]propyl] acetate	85286542	Click to see CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CC(C5C3(C2O)C)O)(C)C)OC7C(C(C(CO7)O)O)O)C)O)C(C(C)(C)O)OC(=O)C	696.90	unknown	https://doi.org/10.1248/CPB.44.2078
[2-Methoxy-2-methyl-1-[10,11,14-trihydroxy-4,6,12,17,17-pentamethyl-18-(3,4,5-trihydroxyoxan-2-yl)oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]propyl] acetate	85165546	Click to see	710.90	unknown	https://doi.org/10.1248/CPB.44.2078
[2-Methoxy-2-methyl-1-[10,11,20-trihydroxy-4,6,12,17,17-pentamethyl-18-(3,4,5-trihydroxyoxan-2-yl)oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]propyl] acetate	85286595	Click to see	710.90	unknown	https://doi.org/10.1248/CPB.44.2078
2-[(1S,2R,3S,4R,7R,9S,12R,14S,17R,18R,19R,21R,22S)-2-hydroxy-3,8,8,17,19-pentamethyl-9-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-22-yl]propan-2-yl acetate	102600400	Click to see	692.90	unknown	https://doi.org/10.1248/CPB.44.2078
2-[(1S,2R,3S,4R,7R,9S,12R,14S,17R,18R,19R,21R,22S)-2-hydroxy-3,8,8,17,19-pentamethyl-9-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-22-yl]propan-2-yl acetate	15786373	Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(C(O8)CO)O)O)O)C)O2)C(C)(C)OC(=O)C	692.90	unknown	https://doi.org/10.1248/CPB.44.2078
2-[(1S,2R,3S,4R,7R,9S,12R,14S,17R,18R,19R,21R,22S)-9-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxy-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-22-yl]propan-2-yl acetate	163037093	Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)OC9C(C(C(C(O9)CO)O)O)O)O)C)O2)C(C)(C)OC(=O)C	825.00	unknown	https://doi.org/10.1248/CPB.42.1940
2-[(1S,2R,3S,4R,7S,9S,11S,12S,14S,17R,18R,19R,21R,22S)-2,11-dihydroxy-3,8,8,17,19-pentamethyl-9-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-22-yl]propan-2-yl acetate	15225907	Click to see CC1CC2C(OC3(C1C4(CCC56CC57C(CCC6C4(C3O)C)C(C(CC7O)OC8C(C(C(CO8)O)O)O)(C)C)C)O2)C(C)(C)OC(=O)C	678.80	unknown	https://doi.org/10.1248/CPB.43.279
2-[[2-Hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol	73156999	Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(C(O8)CO)O)O)O)C)O2)C(C)(C)O	650.80	unknown	https://doi.org/10.1248/CPB.44.2078 https://doi.org/10.1248/CPB.47.511
2-[[2-Hydroxy-22-(2-methoxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol	85184227	Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(C(O8)CO)O)O)O)C)O2)C(C)(C)OC	664.90	unknown	https://doi.org/10.1248/CPB.44.2078
2-[[2,11-Dihydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol	85193499	Click to see	666.80	unknown	https://doi.org/10.1248/CPB.47.511
2-[[2,11-Dihydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]oxane-3,4,5-triol	73091670	Click to see	636.80	unknown	https://doi.org/10.1248/CPB.47.511
2-[2-Hydroxy-3,8,8,17,19-pentamethyl-9-(3,4,5-trihydroxyoxan-2-yl)oxy-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-22-yl]propan-2-yl acetate	72799835	Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)O)O)C)O2)C(C)(C)OC(=O)C	662.80	unknown	https://doi.org/10.1248/CPB.42.1940
2-[2-Hydroxy-3,8,8,17,19-pentamethyl-9-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-22-yl]propan-2-yl acetate	85175060	Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(C(O8)CO)O)O)O)C)O2)C(C)(C)OC(=O)C	692.90	unknown	https://doi.org/10.1248/CPB.44.2078
2-[2,11-Dihydroxy-3,8,8,17,19-pentamethyl-9-(3,4,5-trihydroxyoxan-2-yl)oxy-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-22-yl]propan-2-yl acetate	162936777	Click to see	678.80	unknown	https://doi.org/10.1248/CPB.43.279
2-[9-[3,5-Dihydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxy-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-22-yl]propan-2-yl acetate	163037092	Click to see	825.00	unknown	https://doi.org/10.1248/CPB.42.1940
25-O-Acetylcimigenol xyloside	91826996	Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)O)O)C)O2)C(C)(C)OC(=O)C	662.80	unknown	https://doi.org/10.1248/CPB.42.1940
Cimigenol xyloside	16088242	Click to see CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)O)O)C)O2)C(C)(C)O	620.80	unknown	https://doi.org/10.1248/YAKUSHI1947.103.3_293
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / N-acyl-alpha amino acids / N-acyl-L-alpha-amino acids
N-Acetyl-L-Cysteine	12035	Click to see	163.20	unknown	https://doi.org/10.1248/CPB.46.467
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Aryl-aldehydes
5-Methylfurfural	12097	Click to see CC1=CC=C(O1)C=O	110.11	unknown	via CMAUP database
Furfural	7362	Click to see C1=COC(=C1)C=O	96.08	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Medium-chain aldehydes
2,4-Decadienal	5283349	Click to see	152.23	unknown	via CMAUP database
Decanal	8175	Click to see	156.26	unknown	via CMAUP database
Dodecanal	8194	Click to see	184.32	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
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Alpha,beta-unsaturated ketones / Enones
(3Z)-6-methylhepta-3,5-dien-2-one	12510894	Click to see CC(=CC=CC(=O)C)C	124.18	unknown	via CMAUP database
6-Methyl-3,5-heptadien-2-one	5370101	Click to see CC(=CC=CC(=O)C)C	124.18	unknown	via CMAUP database
Damascenone	5366074	Click to see CC=CC(=O)C1=C(C=CCC1(C)C)C	190.28	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aryl ketones / Aryl alkyl ketones
2-Acetylpyrrole	14079	Click to see	109.13	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones
2-(Hex-3-enyl)cyclopentan-1-one	6437472	Click to see CCC=CCCC1CCCC1=O	166.26	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones
6-Methyl-5-hepten-2-one	9862	Click to see	126.20	unknown	via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Phenylketones / Alkyl-phenylketones
1-(3,5-Dihydroxyphenyl)nonan-1-one	49778007	Click to see	250.33	unknown	https://doi.org/10.1248/CPB.46.362
3-Methoxyacetophenone	11460	Click to see	150.17	unknown	via CMAUP database
Paeonol	11092	Click to see CC(=O)C1=C(C=C(C=C1)OC)O	166.17	unknown	https://doi.org/10.1080/14786410500182037
Resacetophenone	6990	Click to see CC(=O)C1=C(C=C(C=C1)O)O	152.15	unknown	via CMAUP database
> Organoheterocyclic compounds / Benzofurans / Dibenzofurans
Dibenzofuran	568	Click to see	168.19	unknown	via CMAUP database
> Organoheterocyclic compounds / Benzopyrans / 1-benzopyrans / Chromones / Furanochromones
Ammiol	621572	Click to see COC1=C2C(=O)C=C(OC2=C(C3=C1C=CO3)OC)CO	276.24	unknown	via CMAUP database
Cimifugin	441960	Click to see CC(C)(C1CC2=C(O1)C=C3C(=C2OC)C(=O)C=C(O3)CO)O	306.31	unknown	via CMAUP database
Khellol	164613	Click to see	246.21	unknown	via CMAUP database
> Organoheterocyclic compounds / Heteroaromatic compounds
2-Pentylfuran	19602	Click to see	138.21	unknown	via CMAUP database
> Organoheterocyclic compounds / Indoles and derivatives / Carbazoles
2-Methyl-7-hydroxycarbazole	68547224	Click to see	197.23	unknown	https://doi.org/10.3987/COM-93-6472
> Organoheterocyclic compounds / Indoles and derivatives / Indoles
Indole	798	Click to see	117.15	unknown	via CMAUP database
> Organoheterocyclic compounds / Isobenzofurans
(E)-3-Butylidene-4,5-dihydroisobenzofuran-1(3H)-one	5877292	Click to see	190.24	unknown	via CMAUP database
Ligustilide	5319022	Click to see	190.24	unknown	via CMAUP database
> Organoheterocyclic compounds / Lactones / Delta valerolactones
[(1S,4aR,7S,8S,8aS)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-7-methyl-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-yl] (2S)-2-methylbutanoate	11303936	Click to see CCC(C)C(=O)OC1CCCC2C1C(C(C=C2)C)CCC3CC(CC(=O)O3)O	392.50	unknown	https://doi.org/10.1248/CPB.44.2078 https://doi.org/10.1248/CPB.47.511
> Organoheterocyclic compounds / Lactones / Gamma butyrolactones
Gamma-nonalactone	7710	Click to see CCCCCC1CCC(=O)O1	156.22	unknown	via CMAUP database
> Organoheterocyclic compounds / Tetrahydrofurans
Linalool oxide	22310	Click to see CC1(CCC(O1)C(C)(C)O)C=C	170.25	unknown	via CMAUP database
> Organosulfur compounds
(4s,6r,z)-4-Methylundeca-1,9-diene-6-sulfonothioic acid	21776380	Click to see CC=CCCC(CC(C)CC=C)S(=O)(=S)O	262.40	unknown	https://doi.org/10.1248/CPB.44.2078 https://doi.org/10.1248/CPB.47.511
> Phenylpropanoids and polyketides / Cinnamaldehydes
Cinnamaldehyde	637511	Click to see	132.16	unknown	via CMAUP database
cis-Cinnamaldehyde	6428995	Click to see	132.16	unknown	https://doi.org/10.1080/14786410500182037
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives
(2R,3S)-2-[(3,4-dihydroxyphenyl)methyl]-3-[3-(3,4-dimethoxyphenyl)prop-2-enoyloxy]-2-hydroxybutanedioic acid	162900529	Click to see COC1=C(C=C(C=C1)C=CC(=O)OC(C(=O)O)C(CC2=CC(=C(C=C2)O)O)(C(=O)O)O)OC	462.40	unknown	https://doi.org/10.1021/NP900752T
(2S,3R)-2-Hydroxy-3-(3-methoxy-4-hydroxycinnamoyloxy)-2-[(3,4-dihydroxyphenyl)methyl]butanedioic acid	100913813	Click to see COC1=C(C=CC(=C1)C=CC(=O)OC(C(=O)O)C(CC2=CC(=C(C=C2)O)O)(C(=O)O)O)O	448.40	unknown	via CMAUP database
(4R)-3-[(3,4-dihydroxyphenyl)methyl]-4-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3-hydroxyhexanedioic acid	5317411	Click to see	462.40	unknown	https://doi.org/10.1248/CPB.46.362
2-[(3,4-Dihydroxyphenyl)methyl]-2-hydroxy-3-[3-(3-hydroxy-4-methoxyphenyl)prop-2-enoyloxy]butanedioic acid	78410703	Click to see	448.40	unknown	https://doi.org/10.1248/CPB.46.362
2-[(3,4-Dihydroxyphenyl)methyl]-2-hydroxy-3-[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyloxy]butanedioic acid	78410702	Click to see	448.40	unknown	https://doi.org/10.1248/CPB.46.362
2-[(3,4-Dihydroxyphenyl)methyl]-3-[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-2-hydroxybutanedioic acid	76046285	Click to see C1=CC(=C(C=C1CC(C(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)(C(=O)O)O)O)O	434.30	unknown	https://doi.org/10.1248/CPB.46.362
2-[(3,4-Dihydroxyphenyl)methyl]-3-[3-(3,4-dimethoxyphenyl)prop-2-enoyloxy]-2-hydroxybutanedioic acid	73043779	Click to see	462.40	unknown	https://doi.org/10.1021/NP900752T
2-Hydroxy-3-[3-(3-hydroxy-4-methoxyphenyl)prop-2-enoyloxy]-2-[(4-hydroxyphenyl)methyl]butanedioic acid	78410759	Click to see COC1=C(C=C(C=C1)C=CC(=O)OC(C(=O)O)C(CC2=CC=C(C=C2)O)(C(=O)O)O)O	432.40	unknown	https://doi.org/10.1016/S0031-9422(98)00407-5
2-Hydroxy-3-[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyloxy]-2-[(4-hydroxyphenyl)methyl]butanedioic acid	85088918	Click to see COC1=C(C=CC(=C1)C=CC(=O)OC(C(=O)O)C(CC2=CC=C(C=C2)O)(C(=O)O)O)O	432.40	unknown	https://doi.org/10.1016/S0031-9422(98)00407-5
3-[3-(3,4-Dihydroxyphenyl)prop-2-enoyloxy]-2-hydroxy-2-[(4-hydroxyphenyl)methyl]butanedioic acid	73082224	Click to see	418.30	unknown	https://doi.org/10.1016/S0031-9422(98)00407-5
3,4-Dimethoxycinnamic acid	717531	Click to see COC1=C(C=C(C=C1)C=CC(=O)O)OC	208.21	unknown	https://doi.org/10.1248/CPB.46.362
Cimicifugic acid A	6449879	Click to see COC1=C(C=CC(=C1)C=CC(=O)OC(C(=O)O)C(CC2=CC(=C(C=C2)O)O)(C(=O)O)O)O	448.40	unknown	https://doi.org/10.1248/CPB.46.362
Cimicifugic Acid B	6449880	Click to see	448.40	unknown	https://doi.org/10.1248/CPB.46.362
Cimicifugic Acid D	11742743	Click to see	418.30	unknown	https://doi.org/10.1016/S0031-9422(98)00407-5
Cimicifugic acid E	10002902	Click to see	432.40	unknown	https://doi.org/10.1016/S0031-9422(98)00407-5
Cimicifugic acid F	6450179	Click to see COC1=C(C=C(C=C1)C=CC(=O)OC(C(=O)O)C(CC2=CC=C(C=C2)O)(C(=O)O)O)O	432.40	unknown	https://doi.org/10.1016/S0031-9422(98)00407-5
Cimicifugic Acid L	46210732	Click to see	446.40	unknown	https://doi.org/10.1021/NP900752T
Cimicifugic Acid M	46210733	Click to see	402.40	unknown	https://doi.org/10.1021/NP900752T
Cimicifugic Acid N	46210734	Click to see	462.40	unknown	https://doi.org/10.1021/NP900752T
Cimiracemate A	5315874	Click to see	358.30	unknown	via CMAUP database
Cimiracemate B	5315876	Click to see	358.30	unknown	via CMAUP database
Cimiracemate C	5315877	Click to see COC1=C(C=C(C=C1)C=CC(=O)OCC(=O)C(C2=CC(=C(C=C2)O)O)OC)O	388.40	unknown	via CMAUP database
Cimiracemate D	5315878	Click to see COC1=C(C=CC(=C1)C=CC(=O)OCC(=O)C(C2=CC(=C(C=C2)O)O)OC)O	388.40	unknown	via CMAUP database
Fukinolic acid	6441059	Click to see C1=CC(=C(C=C1CC(C(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)(C(=O)O)O)O)O	434.30	unknown	https://doi.org/10.1248/CPB.46.362
Methyl Caffeate	689075	Click to see	194.18	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acid esters / Coumaric acid esters
2-[(3,4-Dihydroxyphenyl)methyl]-2-hydroxy-3-[3-(4-hydroxyphenyl)prop-2-enoyloxy]butanedioic acid	76046101	Click to see	418.30	unknown	https://doi.org/10.1248/CPB.46.362
Cimicifugic Acid C	6450178	Click to see	418.30	unknown	https://doi.org/10.1016/S0031-9422(00)80460-4 https://doi.org/10.1248/CPB.46.362
Cimicifugic acid K	46210731	Click to see C1=CC(=CC=C1CC(C(C(=O)O)OC(=O)C=CC2=CC=C(C=C2)O)(C(=O)O)O)O	402.40	unknown	https://doi.org/10.1021/NP900752T
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids
3-(3-Hydroxy-4-methoxy-phenyl)-acrylic acid	92126	Click to see COC1=C(C=C(C=C1)C=CC(=O)O)O	194.18	unknown	https://doi.org/10.1021/NP900752T https://doi.org/10.1248/CPB.46.362
3-(3,4-Dihydroxyphenyl)Prop-2-Enoic Acid	2518	Click to see	180.16	unknown	https://doi.org/10.1248/CPB.46.362 https://doi.org/10.1021/NP900752T
3-(4-Hydroxy-3-Methoxyphenyl)Prop-2-Enoic Acid	709	Click to see	194.18	unknown	https://doi.org/10.1248/CPB.46.362
4-Coumaric acid	322	Click to see	164.16	unknown	https://doi.org/10.1248/CPB.46.362
Caffeic Acid	689043	Click to see	180.16	unknown	https://doi.org/10.1248/CPB.46.362
cis-Caffeic acid	1549111	Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O	180.16	unknown	via CMAUP database
Ferulic Acid	445858	Click to see	194.18	unknown	https://doi.org/10.1248/CPB.46.362
Isoferulic Acid	736186	Click to see	194.18	unknown	https://doi.org/10.1021/NP900752T https://doi.org/10.1248/CPB.46.362
P-Coumaric Acid	637542	Click to see	164.16	unknown	https://doi.org/10.1248/CPB.46.362
Sinapinic acid	637775	Click to see COC1=CC(=CC(=C1O)OC)C=CC(=O)O	224.21	unknown	via CMAUP database
Sinapinic acid	1549091	Click to see	224.21	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 6,7-dihydroxycoumarins
Esculetin	5281416	Click to see	178.14	unknown	via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Flavanones
7-Hydroxy-8-(3-hydroxy-3-methylbut-1-enyl)-2-phenyl-2,3-dihydrochromen-4-one	74323707	Click to see	324.40	unknown	https://doi.org/10.1248/CPB.46.362
> Phenylpropanoids and polyketides / Phenylpropanoic acids
2,3-Dihydroxy-2-((4-hydroxyphenyl)methyl)butanedioic acid	120693	Click to see	256.21	unknown	https://doi.org/10.1016/S0031-9422(98)00407-5
CID 6710641	6710641	Click to see C1=CC(=CC=C1CC(C(C(=O)O)O)(C(=O)O)O)O	256.21	unknown	via CMAUP database
Fukiic acid	161871	Click to see C1=CC(=C(C=C1CC(C(C(=O)O)O)(C(=O)O)O)O)O	272.21	unknown	https://doi.org/10.1248/CPB.46.362
Piscidic Acid	10038020	Click to see	256.21	unknown	https://doi.org/10.1016/S0031-9422(00)80460-4 https://doi.org/10.1016/S0031-9422(98)00407-5
> Phenylpropanoids and polyketides / Stilbenes
4-((Z)-2-(3-Methoxyphenyl)Ethenyl)Phenol	5469252	Click to see	226.27	unknown	via CMAUP database

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Actaea simplex

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