Rheum officinale - Unknown
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Internal ID UUID643ff8ca3f02f565019081
Scientific name Rheum officinale
Authority Baill.
First published in Adansonia 10: 246 (1872)

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Language Common/alternative name
English chinese rhubarb
Arabic راوند مخزني
ban klembak
Bulgarian лечебен ревен
Persian ریوند چینی
Finnish rohtoraparperi
Indonesian kelembak
Indonesian rheum palmatum
Indonesian klembak
jv klembak
mad klèmbâ'
Malay kelembak
Polish rabarbar lekarski
Russian Ревень лекарственный
Swedish läkerabarber
Thai ตั้งอึ๊ง
Ukrainian Ревінь лікарський
Chinese 大黄
Chinese 大黄茎
Chinese 药用大黄
Chinese 药用大黄(大黄、南大黄)
Chinese 高山大黄
Chinese 馬蹄大黃

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Varieties (abbr. var.) Top

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Distribution (via POWO/KEW) Top

Legend for the distribution data:
- Doubtful data
- Extinct
- Introduced
- Native
  • Asia-temperate
    • China
      • China North-central
      • China South-central
      • China Southeast
  • Europe
    • Middle Europe
      • Czechoslovakia
    • Northern Europe
      • Great Britain

Links to other databases Top

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Database ID/link to page
World Flora Online wfo-0000404454
UNII VC3KP6B2CE
USDA Plants RHOF
Tropicos 26001863
Flora of Italy 10442
KEW urn:lsid:ipni.org:names:696768-1
The Plant List kew-2425521
PFAF Rheum officinale
Open Tree Of Life 173973
Observations.org 136387
NCBI Taxonomy 137220
NBN Atlas NHMSYS0000462346
IPNI 696768-1
iNaturalist 347650
GBIF 2888865
Freebase /m/026rzm8
EPPO RHEOF
EOL 489444
USDA GRIN 31117
Wikipedia Rheum_officinale
CMAUP NPO20881

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
Prediction of potential mechanisms of rhubarb therapy for colorectal cancer based on network pharmacological analysis and molecular docking Yang F, Li X, Zhang Y, Ren Y, Zhang J, Xiao K Medicine (Baltimore) 22-Mar-2024
PMCID:PMC10957024
doi:10.1097/MD.0000000000037477
PMID:38518016
Jian-Pi-Gu-Shen-Hua-Yu Decoction Alleviated Diabetic Nephropathy in Mice through Reducing Ferroptosis Lv S, Fan L, Chen X, Su X, Dong L, Wang Q, Wang Y, Zhang H, Cui H, Zhang S, Wang L J Diabetes Res 16-Mar-2024
PMCID:PMC10960652
doi:10.1155/2024/9990304
PMID:38523631
Potential application of Nardostachyos Radix et Rhizoma-Rhubarb for the treatment of diabetic kidney disease based on network pharmacology and cell culture experimental verification Che MY, Yuan L, Min J, Xu DJ, Lu DD, Liu WJ, Wang KL, Wang YY, Nan Y World J Diabetes 15-Mar-2024
PMCID:PMC10999050
doi:10.4239/wjd.v15.i3.530
PMID:38591077
Chinmedomics: a potent tool for the evaluation of traditional Chinese medicine efficacy and identification of its active components Wang M, Yin F, Kong L, Yang L, Sun H, Sun Y, Yan G, Han Y, Wang X Chin Med 13-Mar-2024
PMCID:PMC10935806
doi:10.1186/s13020-024-00917-x
PMID:38481256
Traditional Chinese medicine treats ulcerative colitis by regulating gut microbiota, signaling pathway and cytokine: Future novel method option for pharmacotherapy Wang T, Liu X, Zhang W, Wang J, Wang T, Yue W, Ming L, Cheng J, Sun J Heliyon 06-Mar-2024
PMCID:PMC10945194
doi:10.1016/j.heliyon.2024.e27530
PMID:38501018
Genomic insight into the origin, domestication, dispersal, diversification and human selection of Tartary buckwheat He Y, Zhang K, Shi Y, Lin H, Huang X, Lu X, Wang Z, Li W, Feng X, Shi T, Chen Q, Wang J, Tang Y, Chapman MA, Germ M, Luthar Z, Kreft I, Janovská D, Meglič V, Woo SH, Quinet M, Fernie AR, Liu X, Zhou M Genome Biol 27-Feb-2024
PMCID:PMC10898187
doi:10.1186/s13059-024-03203-z
PMID:38414075
Effectiveness of adjuvant traditional Chinese medicine on macrovascular invasion in patients with hepatocellular carcinoma: a real-world propensity score-matched study Yan H, Wang X, Yu L, Liu X, Yan F, Xie Y, Pu Q, Yang Z Front Pharmacol 23-Feb-2024
PMCID:PMC10923102
doi:10.3389/fphar.2024.1353720
PMID:38464727
Topical rhubarb charcoal-crosslinked chitosan/silk fibroin sponge scaffold for the repair of diabetic ulcers improves hepatic lipid deposition in db/db mice via the AMPK signalling pathway Tan Q, He Q, Peng Z, Zeng X, Liu Y, Li D, Wang S, Wang J Lipids Health Dis 20-Feb-2024
PMCID:PMC10877747
doi:10.1186/s12944-024-02041-z
PMID:38378566
Physcion inhibition of CYP2C9, 2D6 and 3A4 in human liver microsomes Liu L, Sun S, Li X Pharm Biol 14-Feb-2024
PMCID:PMC10868446
doi:10.1080/13880209.2024.2314089
PMID:38353248
A Prospective, Multicentered, Randomized, Double-Blind, Placebo-Controlled Clinical Trial of Keluoxin Capsules in the Treatment of Microalbuminuria in Patients with Type 2 Early Diabetic Kidney Disease Zhao J, Wang S, Li X, Zhang G, Xu Y, Zheng X, Guo J, Zhang Z J Integr Complement Med 14-Feb-2024
PMCID:PMC10884549
doi:10.1089/jicm.2022.0809
PMID:37733303
Healing of diabetic foot ulcer with topical and oral administrations of herbal products: A systematic review and meta‐analysis of randomized controlled trials Zamanifard M, Nasiri M, Yarahmadi F, Zonoori S, Razani O, Salajegheh Z, Imanipour M, Mohammadi SM, Jomehzadeh N, Asadi M Int Wound J 14-Feb-2024
PMCID:PMC10867296
doi:10.1111/iwj.14760
PMID:38356150
Natural compounds target programmed cell death (PCD) signaling mechanism to treat ulcerative colitis: a review Chen B, Dong X, Zhang JL, Sun X, Zhou L, Zhao K, Deng H, Sun Z Front Pharmacol 09-Feb-2024
PMCID:PMC10885814
doi:10.3389/fphar.2024.1333657
PMID:38405669
From Plant to Chemistry: Sources of Antinociceptive Non-Opioid Active Principles for Medicinal Chemistry and Drug Design Turnaturi R, Piana S, Spoto S, Costanzo G, Reina L, Pasquinucci L, Parenti C Molecules 09-Feb-2024
PMCID:PMC10892999
doi:10.3390/molecules29040815
PMID:38398566
Exploring the clinical efficacy and mechanism of high-position colon dialysis combined with Traditional Chinese Medicine retention enema in real-world patients with stage 3–5 chronic kidney disease (non-dialysis) based on the theory of the Gut–Kidney axis Deng Y, Zhang L, Chen S, Xu D, Wu W, Shen T, Liu Z, Yang L, Wen A, Hou Y, Shao F Front Pharmacol 24-Jan-2024
PMCID:PMC10847354
doi:10.3389/fphar.2023.1246852
PMID:38328574
Pharmacology of bioactive compounds from plant extracts for improving non-alcoholic fatty liver disease through endoplasmic reticulum stress modulation: A comprehensive review Huang L, Tan L, Lv Z, Chen W, Wu J Heliyon 23-Jan-2024
PMCID:PMC10844061
doi:10.1016/j.heliyon.2024.e25053
PMID:38322838

Phytochemical Profile Top

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Below are displayed the proven (via scientific papers) natural compounds!
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Name PubChem ID Canonical SMILES MW Found in Proof
> Benzenoids / Anthracenes
(10R)-1,8-Dihydroxy-3-(hydroxymethyl)-10-[(2S,3S,4R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-10H-anthracen-9-one 12305763 Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C(C(C(C(O4)CO)O)O)O)C=C(C=C3O)CO 418.40 unknown via CMAUP database
(10S)-10-[(9R)-4,5-dihydroxy-2-methyl-10-oxo-9H-anthracen-9-yl]-1,3,8-trihydroxy-6-methyl-10H-anthracen-9-one 44567184 Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC(=C5)C)O)C(=O)C6=C4C=C(C=C6O)O)C=CC=C3O 494.50 unknown via CMAUP database
Aloin 9866696 Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C(C(C(C(O4)CO)O)O)O)C=C(C=C3O)CO 418.40 unknown via CMAUP database
Aloin A 12305761 Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C(C(C(C(O4)CO)O)O)O)C=C(C=C3O)CO 418.40 unknown via CMAUP database
Aloin B 14989 Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C(C(C(C(O4)CO)O)O)O)C=C(C=C3O)CO 418.40 unknown via CMAUP database
Anthrone 7018 Click to see C1C2=CC=CC=C2C(=O)C3=CC=CC=C31 194.23 unknown via CMAUP database
Barbaloin 313325 Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C(C(C(C(O4)CO)O)O)O)C=C(C=C3O)CO 418.40 unknown via CMAUP database
Emodin anthrone 122635 Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2)C=C(C=C3O)O 256.25 unknown via CMAUP database
Palmidin A 5320384 Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC=C5)O)C(=O)C6=C4C=C(C=C6O)CO)C=C(C=C3O)O 510.50 unknown via CMAUP database
Palmidin B 5320385 Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC=C5)O)C(=O)C6=C4C=C(C=C6O)CO)C=CC=C3O 494.50 unknown via CMAUP database
Palmidin C 5320386 Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC(=C5)C)O)C(=O)C6=C4C=C(C=C6O)O)C=CC=C3O 494.50 unknown via CMAUP database
> Benzenoids / Anthracenes / Anthracenecarboxylic acids and derivatives / Anthracenecarboxylic acids
(9R)-4-hydroxy-10-oxo-9-[(3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracene-2-carboxylic acid 11972450 Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C(C(C(C(O5)CO)O)O)O)C=C(C=C4O)C(=O)O 594.50 unknown https://doi.org/10.1248/CPB.35.3132
(9S,9'R)-5,5'-Bis(beta-D-glucopyranosyloxy)-9,9',10,10'-tetrahydro-4,4'-dihydroxy-2'-(hydroxymethyl)-10,10'-dioxo-9,9'-bianthracene-2-carboxylic acid 71312556 Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)CO 848.80 unknown via CMAUP database
(9S)-4,9-dihydroxy-10-oxo-9-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyanthracene-2-carboxylic acid 13888125 Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2(C5C(C(C(C(O5)CO)O)O)O)O)C=C(C=C4O)C(=O)O 610.50 unknown https://doi.org/10.1248/CPB.35.3132
(9S)-4,9-dihydroxy-10-oxo-9-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyanthracene-2-carboxylic acid 11972448 Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2(C5C(C(C(C(O5)CO)O)O)O)O)C=C(C=C4O)C(=O)O 610.50 unknown https://doi.org/10.1248/CPB.35.3132
4-hydroxy-9-[4-hydroxy-2-(hydroxymethyl)-10-oxo-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracen-9-yl]-10-oxo-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracene-2-carboxylic acid 12821233 Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)CO 848.80 unknown via CMAUP database
4-hydroxy-9,10-dioxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(oxalooxymethyl)oxan-2-yl]oxyanthracene-2-carboxylic acid 11972451 Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)COC(=O)C(=O)O)O)O)O)C(=O)C4=C(C2=O)C=C(C=C4O)C(=O)O 518.40 unknown via CMAUP database
4,5-Dihydroxy-7-methyl-9,10-dioxoanthracene-2-carboxylic acid 3009664 Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)C(=O)O 298.25 unknown via CMAUP database
9-[(9R)-2-carboxy-4-hydroxy-10-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracen-9-yl]-4-hydroxy-10-oxo-5-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracene-2-carboxylic acid 53486254 Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O 862.70 unknown via CMAUP database
9-[2-carboxy-5-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-oxalooxyoxan-2-yl]oxy-4-hydroxy-10-oxo-9H-anthracen-9-yl]-4-hydroxy-10-oxo-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracene-2-carboxylic acid 57357348 Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)OC(=O)C(=O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O 934.80 unknown via CMAUP database
9,10-dioxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyanthracene-2-carboxylic acid 5320960 Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2=O)C=C(C=C4OC5C(C(C(C(O5)CO)O)O)O)C(=O)O 608.50 unknown via CMAUP database
Anthraquinone-2-carboxylic acid 67030 Click to see C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O 252.22 unknown via CMAUP database
Glhygfihrknbbp-puooodevsa- 11972449 Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C(C(C(C(O5)CO)O)O)O)C=C(C=C4O)C(=O)O 594.50 unknown https://doi.org/10.1248/CPB.35.3132
Laccaic acid D 9883304 Click to see CC1=C2C(=CC(=C1C(=O)O)O)C(=O)C3=C(C2=O)C(=CC(=C3)O)O 314.25 unknown via CMAUP database
Ojzwdokdqbcanr-zpsauebxsa- 11972447 Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2(C5C(C(C(C(O5)CO)O)O)O)O)C=C(C=C4O)C(=O)O 610.50 unknown https://doi.org/10.1248/CPB.35.3132
Rheidin A 5320957 Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC=C5)O)C(=O)C6=C4C=C(C=C6O)C(=O)O)C=C(C=C3O)O 524.50 unknown via CMAUP database
Rheidin B 5320958 Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC=C5)O)C(=O)C6=C4C=C(C=C6O)C(=O)O)C=CC=C3O 508.50 unknown via CMAUP database
Rheidin C 5320959 Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC=C5)O)C(=O)C6=C4C=C(C=C6O)C(=O)O)C=C(C=C3O)OC 538.50 unknown via CMAUP database
Rhein 10168 Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)C(=O)O 284.22 unknown https://doi.org/10.1016/S0021-9673(99)00827-4
https://doi.org/10.1016/0378-8741(87)90005-5
Rhein-8-glucoside 5320961 Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2=O)C=C(C=C4O)C(=O)O 446.40 unknown via CMAUP database
Rheinoside C 13888128 Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C(C(C(C(O5)CO)O)O)O)C=C(C=C4O)C(=O)O 594.50 unknown https://doi.org/10.1248/CPB.35.3132
Senna-lax 656822 Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O 862.70 unknown via CMAUP database
Sennidin A 92826 Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC=C5)O)C(=O)C6=C4C=C(C=C6O)C(=O)O)C=C(C=C3O)C(=O)O 538.50 unknown via CMAUP database
Sennidin B 10459879 Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC=C5)O)C(=O)C6=C4C=C(C=C6O)C(=O)O)C=C(C=C3O)C(=O)O 538.50 unknown via CMAUP database
Sennidine A 122839 Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC=C5)O)C(=O)C6=C4C=C(C=C6O)C(=O)O)C=C(C=C3O)C(=O)O 538.50 unknown via CMAUP database
Sennoside A 73111 Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O 862.70 unknown https://doi.org/10.1248/CPB.36.1545
Sennoside A, analytical standard 16218404 Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O 862.70 unknown via CMAUP database
Sennoside B 91440 Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O 862.70 unknown via CMAUP database
Sennoside C 46173829 Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)CO 848.80 unknown via CMAUP database
Sennoside D 46173830 Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)CO 848.80 unknown via CMAUP database
> Benzenoids / Anthracenes / Anthraquinones
1-Hydroxyanthraquinone 8512 Click to see C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)O 224.21 unknown via CMAUP database
1,8-Dihydroxy-3-methyl-4a,9a-dihydroanthracene-9,10-dione 24867638 Click to see CC1=CC2C(C(=C1)O)C(=O)C3=C(C2=O)C=CC=C3O 256.25 unknown via CMAUP database
1,8-Dimethoxy-3-methylanthracene-9,10-dione 189763 Click to see CC1=CC2=C(C(=C1)OC)C(=O)C3=C(C2=O)C=CC=C3OC 282.29 unknown via CMAUP database
8-[(6-O-beta-D-Glucopyranosyl-beta-D-glucopyranosyl)oxy]-1-hydroxy-3-methoxy-6-methylanthraquinone 5320543 Click to see CC1=CC2=C(C(=C1)OC3C(C(C(C(O3)COC4C(C(C(C(O4)CO)O)O)O)O)O)O)C(=O)C5=C(C2=O)C=C(C=C5O)OC 608.50 unknown via CMAUP database
Aloe emodin 10207 Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)CO 270.24 unknown https://doi.org/10.1016/S0021-9673(99)00827-4
Aloe-emodin-glucoside 147295 Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)COC4C(C(C(C(O4)CO)O)O)O 432.40 unknown via CMAUP database
Anthraquinone 6780 Click to see C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3C2=O 208.21 unknown via CMAUP database
Chrysophanein 6324923 Click to see CC1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2=O)C=CC=C4O 416.40 unknown via CMAUP database
Chrysophanic acid 10208 Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=CC=C3O 254.24 unknown via CMAUP database
Chrysophanol 8-(6-O-galloyl-beta-D-glucopyranoside) 5315852 Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=CC=C3OC4C(C(C(C(O4)COC(=O)C5=CC(=C(C(=C5)O)O)O)O)O)O 568.50 unknown via CMAUP database
Emodin 6-O-|A-D-glucoside 5317038 Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)OC4C(C(C(C(O4)CO)O)O)O 432.40 unknown via CMAUP database
Physcion 8-gentiobioside 442762 Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3OC4C(C(C(C(O4)COC5C(C(C(C(O5)CO)O)O)O)O)O)O)OC 608.50 unknown via CMAUP database
Physcion 8-glucoside 5319323 Click to see CC1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2=O)C=C(C=C4O)OC 446.40 unknown via CMAUP database
Physcione 10639 Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)OC 284.26 unknown https://doi.org/10.1016/S0021-9673(99)00827-4
Pulmatin 442731 Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=CC=C3OC4C(C(C(C(O4)CO)O)O)O 416.40 unknown via CMAUP database
Rheochrysin 168938 Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3OC4C(C(C(C(O4)CO)O)O)O)OC 446.40 unknown via CMAUP database
> Benzenoids / Anthracenes / Anthraquinones / Hydroxyanthraquinones
1,3,6-Trihydroxy-8-methylanthraquinone 12309204 Click to see CC1=CC(=CC2=C1C(=O)C3=C(C2=O)C=C(C=C3O)O)O 270.24 unknown via CMAUP database
2,6-Dihydroxyanthraquinone 6776 Click to see C1=CC2=C(C=C1O)C(=O)C3=C(C2=O)C=C(C=C3)O 240.21 unknown via CMAUP database
Alizarin 6293 Click to see C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)O)O 240.21 unknown via CMAUP database
Emodin 3220 Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)O 270.24 unknown https://doi.org/10.1016/J.EJPHAR.2007.02.033
https://doi.org/10.1016/S0021-9673(99)00827-4
Emodin 1-O-beta-D-glucoside 5319333 Click to see CC1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2=O)C=C(C=C4O)O 432.40 unknown via CMAUP database
Emodin-8-glucoside 99649 Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3OC4C(C(C(C(O4)CO)O)O)O)O 432.40 unknown via CMAUP database
Emodin(1-) 25201450 Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3[O-])O 269.23 unknown via CMAUP database
Purpurin 6683 Click to see C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)O)O 256.21 unknown via CMAUP database
Quinalizarin 5004 Click to see C1=CC(=C(C2=C1C(=O)C3=C(C=CC(=C3C2=O)O)O)O)O 272.21 unknown via CMAUP database
> 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 C1=C(C=C(C(=C1O)O)O)C(=O)O 170.12 unknown https://doi.org/10.1248/CPB.29.2862
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives / Galloyl esters
[(2S)-2,3-dihydroxypropyl] 3,4,5-trihydroxybenzoate 51543740 Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OCC(CO)O 244.20 unknown via CMAUP database
[(5R)-4,5-dihydroxy-3-(3,4,5-trihydroxybenzoyl)oxy-4-[(3,4,5-trihydroxybenzoyl)oxymethyl]oxolan-2-yl]methyl 3,4,5-trihydroxybenzoate 124024 Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(O2)O)(COC(=O)C3=CC(=C(C(=C3)O)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O 636.50 unknown via CMAUP database
2,3-Dihydroxypropyl 3,4,5-trihydroxybenzoate 5317465 Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OCC(CO)O 244.20 unknown https://doi.org/10.1248/CPB.31.1652
6-O-galloyl-beta-D-glucose 5317463 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 https://doi.org/10.1248/CPB.31.1652
6-O-Galloylglucose 128839 Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OCC(C(C(C(C=O)O)O)O)O 332.26 unknown https://doi.org/10.1248/CPB.31.1652
Glucogallin 124375 Click to see COC1C(C(C(C(O1)OC(=O)C2=CC(=C(C(=C2)O)O)O)O)O)O 332.26 unknown via CMAUP database
Methyl gallate 7428 Click to see COC(=O)C1=CC(=C(C(=C1)O)O)O 184.15 unknown via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Biphenyls and derivatives
Honokiol 72303 Click to see C=CCC1=CC(=C(C=C1)O)C2=CC(=C(C=C2)O)CC=C 266.30 unknown via CMAUP database
Magnolol 72300 Click to see C=CCC1=CC(=C(C=C1)O)C2=C(C=CC(=C2)CC=C)O 266.30 unknown via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Styrenes
Benzylideneacetone 637759 Click to see CC(=O)C=CC1=CC=CC=C1 146.19 unknown via CMAUP database
> Benzenoids / Naphthalenes / Naphthols and derivatives
Torachrysone 5321977 Click to see CC1=CC2=CC(=CC(=C2C(=C1C(=O)C)O)O)OC 246.26 unknown via CMAUP database
> Benzenoids / Phenols / 1-hydroxy-2-unsubstituted benzenoids
4-(4-Hydroxyphenyl)-2-butanone 21648 Click to see CC(=O)CCC1=CC=C(C=C1)O 164.20 unknown https://doi.org/10.1248/CPB.29.2862
> Benzenoids / Phenols / Benzenediols / Resorcinols
2-Methyl-5-(8Z,11Z)-8,11-pentadecadien-1-yl-1,3-benzenediol 5319544 Click to see CCCC=CCC=CCCCCCCCC1=CC(=C(C(=C1)O)C)O 330.50 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters
Docusate 11339 Click to see CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O 422.60 unknown via CMAUP database
> Lipids and lipid-like molecules / Glycerolipids / Monoradylglycerols / Monoacylglycerols / 1-monoacylglycerols
2,3-Dihydroxypropyl hexadecanoate 14900 Click to see CCCCCCCCCCCCCCCC(=O)OCC(CO)O 330.50 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Triterpene glycosides / Triterpene saponins
(2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S,6S)-2-[[(3S,4aS,6aR,6bS,8aS,11R,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-6-carboxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid 46783814 Click to see CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)C)C(=O)C=C6C3(CCC7(C6CC(CC7)(C)C(=O)O)C)C)C)C 822.90 unknown via CMAUP database
(2S,3S,4S,5R,6R)-6-[(2S,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-6-carboxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid 46878350 Click to see CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)C)C(=O)C=C6C3(CCC7(C6CC(CC7)(C)C(=O)O)C)C)C)C 822.90 unknown via CMAUP database
(2S,3S,4S,5R)-6-[(3R,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-6-carboxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid 45358130 Click to see CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)C)C(=O)C=C6C3(CCC7(C6CC(CC7)(C)C(=O)O)C)C)C)C 822.90 unknown via CMAUP database
30-hydroxy-11,30-dioxoolean-12-en-3beta-yl 2-O-beta-D-glucopyranuronosyl-beta-D-glucopyranosiduronic acid 44260118 Click to see CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)C)C(=O)C=C6C3(CCC7(C6CC(CC7)(C)C(=O)O)C)C)C)C 822.90 unknown via CMAUP database
alpha-D-Glucopyranosiduronic acid, (3beta,20beta)-20-carboxy-11-oxo-30-norolean-12-en-3-yl 2-O-beta-D-glucopyranuronosyl- 16213698 Click to see CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)C)C(=O)C=C6C3(CCC7(C6CC(CC7)(C)C(=O)O)C)C)C)C 822.90 unknown via CMAUP database
Glycyrrhizin 14982 Click to see CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)C)C(=O)C=C6C3(CCC7(C6CC(CC7)(C)C(=O)O)C)C)C)C 822.90 unknown via CMAUP database
Liquorice 3495 Click to see CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)C)C(=O)C=C6C3(CCC7(C6CC(CC7)(C)C(=O)O)C)C)C)C 822.90 unknown via CMAUP database
Uralsaponin A 128229 Click to see CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)C)C(=O)C=C6C3(CCC7(C6CC(CC7)(C)C(=O)O)C)C)C)C 822.90 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Tetraterpenoids / Carotenoids / Xanthophylls
Flavochrome 6443299 Click to see CC1=CCCC(C1C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C2C=C3C(CCCC3(O2)C)(C)C)C)C)(C)C 552.90 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
Tripterygone 197388 Click to see CC1=C(C(=O)C=C2C1(CCC3C2CCC4(C3(CCC5(C4CC(CC5)(C)C(=O)O)C)C)C)C)O 454.60 unknown via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Bile acids, alcohols and derivatives / Hydroxy bile acids, alcohols and derivatives
CID 11799446 11799446 Click to see CC(C)C(CC(C(C)(C1CCC2(C1(CC(C3C2=CC(=O)C4C3(CC(C(C4)O)O)C)O)C)O)O)O)O 496.60 unknown via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Pregnane steroids / Gluco/mineralocorticoids, progestogins and derivatives
(8S,10R,13S,17S)-17-acetyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one 16401562 Click to see CC(=O)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C 314.50 unknown via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
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 via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alpha amino acids / L-alpha-amino acids
(2S)-5-amino-2-ammonio-5-oxopentanoate 6992086 Click to see C(CC(=O)N)C(C(=O)[O-])[NH3+] 146.14 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides
1-[1-hydroxy-3-methyl-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynaphthalen-2-yl]ethanone 5319972 Click to see CC1=CC2=C(C(=CC=C2)OC3C(C(C(C(O3)CO)O)O)O)C(=C1C(=O)C)O 378.40 unknown via CMAUP database
1-[1,6-dihydroxy-3-methyl-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynaphthalen-2-yl]ethanone 100753 Click to see CC1=CC2=CC(=CC(=C2C(=C1C(=O)C)O)OC3C(C(C(C(O3)CO)O)O)O)O 394.40 unknown via CMAUP database
2-methyl-4-oxo-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromene-5-carboxylic acid 5315687 Click to see CC1=CC(=O)C2=C(C=C(C=C2O1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)O 382.30 unknown via CMAUP database
4-[(6-O-Galloyl-beta-D-glucopyranosyl)oxy]-4-deoxygallic acid 11972354 Click to see C1=C(C=C(C(=C1O)OC2C(C(C(C(O2)COC(=O)C3=CC(=C(C(=C3)O)O)O)O)O)O)O)C(=O)O 484.40 unknown via CMAUP database
4-[4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]butan-2-one 10172008 Click to see CC(=O)CCC1=CC=C(C=C1)OC2C(C(C(C(O2)CO)O)O)O 326.34 unknown via CMAUP database
5-(beta-D-glucopyranosyloxy)-2-hydroxybenzoic acid 10914066 Click to see C1=CC(=C(C=C1OC2C(C(C(C(O2)CO)O)O)O)C(=O)O)O 316.26 unknown via CMAUP database
CID 10390322 10390322 Click to see CC(=O)CCC1=CC=C(C=C1)OC2C(C(C(C(O2)CO)O)O)OC(=O)C3=CC(=C(C(=C3)O)O)O 478.40 unknown via CMAUP database
Ethanone, 1-[8-[[6-O-(carboxycarbonyl)-beta-D-glucopyranosyl]oxy]-1-hydroxy-6-methoxy-3-methyl-2-naphthalenyl]- 5321979 Click to see CC1=CC2=CC(=CC(=C2C(=C1C(=O)C)O)OC3C(C(C(C(O3)COC(=O)C(=O)O)O)O)O)OC 480.40 unknown via CMAUP database
Isolindleyin 14345583 Click to see CC(=O)CCC1=CC=C(C=C1)OC2C(C(C(C(O2)CO)O)O)OC(=O)C3=CC(=C(C(=C3)O)O)O 478.40 unknown https://doi.org/10.1248/CPB.31.1652
Lindleyin 42994 Click to see CC(=O)CCC1=CC=C(C=C1)OC2C(C(C(C(O2)COC(=O)C3=CC(=C(C(=C3)O)O)O)O)O)O 478.40 unknown https://doi.org/10.1248/CPB.29.2862
Raspberryketone glucoside 5320521 Click to see CC(=O)CCC1=CC=C(C=C1)OC2C(C(C(C(O2)CO)O)O)O 326.34 unknown via CMAUP database
Torachrysone 8-O-Glucoside 11972479 Click to see CC1=CC2=CC(=CC(=C2C(=C1C(=O)C)O)OC3C(C(C(C(O3)CO)O)O)O)OC 408.40 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides / Hexoses
[(2R,3R,4S,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl] (E)-3-phenylprop-2-enoate 11972309 Click to see C1=CC=C(C=C1)C=CC(=O)OC2C(C(C(OC2O)CO)O)O 310.30 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Sugar alcohols
Sorbitol 5780 Click to see C(C(C(C(C(CO)O)O)O)O)O 182.17 unknown via CMAUP database
> Organoheterocyclic compounds / Benzopyrans / 1-benzopyrans / Chromones
2-[(2S)-2-Hydroxypropyl]-5-methyl-7-hydroxy-4H-1-benzopyran-4-one 45272307 Click to see CC1=CC(=CC2=C1C(=O)C=C(O2)CC(C)O)O 234.25 unknown via CMAUP database
2H-1-Benzopyran-5-acetic acid, 3,4-dihydro-7-hydroxy-2-methyl-4-oxo-, (S)- 5319543 Click to see CC1CC(=O)C2=C(C=C(C=C2O1)O)CC(=O)O 236.22 unknown via CMAUP database
4H-1-Benzopyran-4-one, 5-acetyl-7-hydroxy-2-methyl- 5315891 Click to see CC1=CC(=O)C2=C(C=C(C=C2O1)O)C(=O)C 218.20 unknown via CMAUP database
7-Hydroxy-2-methyl-4-oxo-4H-1-benzopyran-5-acetic acid 14429402 Click to see CC1=CC(=O)C2=C(C=C(C=C2O1)O)CC(=O)O 234.20 unknown via CMAUP database
7-Hydroxy-2-methyl-4-oxo-4H-1-benzopyran-5-carboxylic acid 5315688 Click to see CC1=CC(=O)C2=C(C=C(C=C2O1)O)C(=O)O 220.18 unknown via CMAUP database
Cassiachromone 5319500 Click to see CC1=CC(=O)C2=C(C=C(C=C2O1)O)CC(=O)C 232.23 unknown via CMAUP database
> Organoheterocyclic compounds / Indoles and derivatives / Tryptamines and derivatives / Serotonins
Serotonin 5202 Click to see C1=CC2=C(C=C1O)C(=CN2)CCN 176.21 unknown via CMAUP database
> Organoheterocyclic compounds / Naphthofurans
methyl (6S,7R,8S,10S,14S,16R,22R,23R,25S)-7,14,23-trihydroxy-4-methoxy-6,16,22-trimethyl-25-[(E)-3-phenylprop-2-enoyl]oxy-3,9,11,17,20-pentaoxaoctacyclo[17.6.1.18,15.01,5.06,18.07,16.010,14.022,26]heptacos-12-ene-4-carboxylate 24893812 Click to see CC12COC3C1C4(COC(C4C5(C3OC6(C5(C7CC6C8(C=COC8O7)O)O)C)C)(C(=O)OC)OC)C(CC2O)OC(=O)C=CC9=CC=CC=C9 696.70 unknown via CMAUP database
> Organoheterocyclic compounds / Naphthopyrans / Naphthopyranones
Toralactone 5321980 Click to see CC1=CC2=CC3=CC(=CC(=C3C(=C2C(=O)O1)O)O)OC 272.25 unknown via CMAUP database
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Cinnamic acids
Cinnamic acid 444539 Click to see C1=CC=C(C=C1)C=CC(=O)O 148.16 unknown via CMAUP database
cis-Cinnamic acid 5372954 Click to see C1=CC=C(C=C1)C=CC(=O)O 148.16 unknown via CMAUP database
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives
3-[(E)-3-(3,5-dihydroxyphenyl)prop-2-enoyl]-5-hydroxy-3,4-dihydropyran-2-one 5320968 Click to see C1C(C(=O)OC=C1O)C(=O)C=CC2=CC(=CC(=C2)O)O 276.24 unknown via CMAUP database
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids
Caffeic Acid 689043 Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O 180.16 unknown via CMAUP database
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 COC1=C(C=CC(=C1)C=CC(=O)O)O 194.18 unknown via CMAUP database
> Phenylpropanoids and polyketides / Depsides and depsidones
(3R,5R)-4-[3,4-dihydroxy-5-(3,4,5-trihydroxybenzoyl)oxybenzoyl]oxy-1-hydroxy-3,5-bis[(3,4,5-trihydroxybenzoyl)oxy]cyclohexane-1-carboxylic acid 442676 Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C2=CC(=C(C(=C2)O)O)O)OC(=O)C3=CC(=C(C(=C3)OC(=O)C4=CC(=C(C(=C4)O)O)O)O)O)OC(=O)C5=CC(=C(C(=C5)O)O)O 800.60 unknown via CMAUP database
> Phenylpropanoids and polyketides / Diarylheptanoids / Linear diarylheptanoids
Tocris-1610 6603986 Click to see CC1=C(C(=C(C(=C1O)C(=O)C)O)CC2=C(C(=C3C(=C2O)C=CC(O3)(C)C)C(=O)C=CC4=CC=CC=C4)O)O 516.50 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Biflavonoids and polyflavonoids
[2-(3,4-dihydroxyphenyl)-6-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate 5320714 Click to see C1C(C(OC2=C1C(=C(C(=C2)O)C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)C6=CC(=C(C=C6)O)O)OC(=O)C7=CC(=C(C(=C7)O)O)O 730.60 unknown via CMAUP database
3,3'-Digalloylprocyanidin B2 124016 Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O)O)O)C7=CC(=C(C=C7)O)O)OC(=O)C8=CC(=C(C(=C8)O)O)O 882.70 unknown via CMAUP database
Bis(3,4,5-trihydroxybenzoic acid)2alpha,2'alpha-bis(3,4-dihydroxyphenyl)-5,5',7,7'-tetrahydroxy-4,8'-bichroman-3alpha,3'alpha-diyl ester 12795894 Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O)O)O)C7=CC(=C(C=C7)O)O)OC(=O)C8=CC(=C(C(=C8)O)O)O 882.70 unknown via CMAUP database
Catechin tetramer 101236698 Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C3C(=CC(=C4C5C(C(OC6=C(C(=CC(=C56)O)O)C7C(C(OC8=CC(=CC(=C78)O)O)C9=CC(=C(C=C9)O)O)O)C1=CC(=C(C=C1)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O 1155.00 unknown via CMAUP database
Endotelon 130556 Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O 578.50 unknown via CMAUP database
Procyanidin B-5 3,3'-di-O-gallate 3086518 Click to see C1C(C(OC2=C1C(=C(C(=C2)O)C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O)O)C7=CC(=C(C=C7)O)O)OC(=O)C8=CC(=C(C(=C8)O)O)O 882.70 unknown via CMAUP database
procyanidin B1 3-O-gallate 12795888 Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O)O)O)C7=CC(=C(C=C7)O)O)O 730.60 unknown via CMAUP database
Procyanidin B2 3'-O-gallate 15593124 Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)OC(=O)C7=CC(=C(C(=C7)O)O)O 730.60 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins
(-)-Catechin 73160 Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O 290.27 unknown via CMAUP database
(+)-Epicatechin 182232 Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O 290.27 unknown via CMAUP database
(+/-)-Epicatechin 255538 Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O 290.27 unknown via CMAUP database
2-(3,4-Dihydroxyphenyl)chroman-3,5,7-triol 1203 Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O 290.27 unknown via CMAUP database
Catechin pentaacetate 5315742 Click to see CC(=O)OC1CC2=C(C=C(C=C2OC(=O)C)OC(=O)C)OC1C3=CC(=C(C=C3)OC(=O)C)OC(=O)C 500.40 unknown via CMAUP database
Cianidanol 9064 Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O 290.27 unknown https://doi.org/10.1248/CPB.29.2862
https://doi.org/10.1248/CPB.36.1545
Epicatechin 72276 Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O 290.27 unknown via CMAUP database
Epicatechin pentaacetate 5317058 Click to see CC(=O)OC1CC2=C(C=C(C=C2OC(=O)C)OC(=O)C)OC1C3=CC(=C(C=C3)OC(=O)C)OC(=O)C 500.40 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins / Catechin gallates
(-)-Catechin gallate 6419835 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 via CMAUP database
(-)-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/10.1016/S0944-7113(97)80075-X
(-)-Epicatechingallate 367141 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 via CMAUP database
(+)-Catechin gallate 5276454 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 via CMAUP database
Epicatechin-3-gallate 65056 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 via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins / Epigallocatechins
(2R)-2alpha-(3,4,5-Trihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran 12309543 Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)O 306.27 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Flavan-3-ols
Flavan-3-ol 3707243 Click to see C1C(C(OC2=CC=CC=C21)C3=CC=CC=C3)O 226.27 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavones
Baicalein 5281605 Click to see C1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C(=C3O)O)O 270.24 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glucuronides / Flavonoid-7-O-glucuronides
Baicalin 64982 Click to see C1=CC=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O 446.40 unknown via CMAUP database
Oroxindin 3084961 Click to see COC1=C(C=C(C2=C1OC(=CC2=O)C3=CC=CC=C3)O)OC4C(C(C(C(O4)C(=O)O)O)O)O 460.40 unknown via CMAUP database
Oroxylin A glucoronide 14655552 Click to see COC1=C(C=C2C(=C1O)C(=O)C=C(O2)C3=CC=CC=C3)OC4C(C(C(C(O4)C(=O)O)O)O)O 460.40 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides
(+)-Catechin 5-O-beta-D-glucopyranoside 6324898 Click to see C1C(C(OC2=C1C(=CC(=C2)O)OC3C(C(C(C(O3)CO)O)O)O)C4=CC(=C(C=C4)O)O)O 452.40 unknown via CMAUP database
(2S,3R,4S,5S,6R)-2-[(2R,3R)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-chroman-5-yl]oxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol 10343835 Click to see C1C(C(OC2=C1C(=CC(=C2)O)OC3C(C(C(C(O3)CO)O)O)O)C4=CC(=C(C=C4)O)O)O 452.40 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
Rutin 5280805 Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O 610.50 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides
(2S)-7-[[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-oxanyl]oxy]-2-oxanyl]oxy]-5-hydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one 6710627 Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O 580.50 unknown via CMAUP database
(2S)-7-[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one 5351463 Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O 580.50 unknown via CMAUP database
4H-1-Benzopyran-4-one, 7-((2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-, (S)- 5284651 Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O 580.50 unknown via CMAUP database
4H-1-Benzopyran-4-one, 7-[[2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-, (2S)- 4441 Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O 580.50 unknown via CMAUP database
4H-1-Benzopyran-4-one, 7-[[2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-, (S)- 91740219 Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O 580.50 unknown via CMAUP database
4H-1-Benzopyran-4-one, 7-[[6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-, (S)- 3594 Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)OC)O)O)O)O)O)O)O)O 610.60 unknown via CMAUP database
7-[(2R,3S,4R,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one 45358136 Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O 580.50 unknown via CMAUP database
7-[(2S,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one 74787988 Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O 580.50 unknown via CMAUP database
7-[[2-O-(6-deoxy-alpha-l-mannopyranosyl)-beta-d-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-4h-1-benzopyran-4-one 25075 Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O 580.50 unknown via CMAUP database
Hesperidin 10621 Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)OC)O)O)O)O)O)O)O)O 610.60 unknown via CMAUP database
Naringin 442428 Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O 580.50 unknown via CMAUP database
Naringin [10236-47-2] 45933923 Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O 580.50 unknown via CMAUP database
> Phenylpropanoids and polyketides / Isoflavonoids / Coumestans
1,3-Dihydroxy-8,9-dimethoxy-[1]benzofuro[3,2-c]chromen-6-one 11602329 Click to see COC1=C(C=C2C(=C1)C3=C(O2)C4=C(C=C(C=C4OC3=O)O)O)OC 328.27 unknown https://doi.org/10.1016/S0021-9673(99)00827-4
> Phenylpropanoids and polyketides / Stilbenes
(E)-5-(4-Methoxystyryl)benzene-1,3-diol 6255462 Click to see COC1=CC=C(C=C1)C=CC2=CC(=CC(=C2)O)O 242.27 unknown via CMAUP database
(Z)-resveratrol 1548910 Click to see C1=CC(=CC=C1C=CC2=CC(=CC(=C2)O)O)O 228.24 unknown via CMAUP database
4-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-2-methoxyphenol 5809575 Click to see COC1=CC(=CC(=C1)C=CC2=CC(=C(C=C2)O)OC)OC 286.32 unknown via CMAUP database
5-[(E)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]benzene-1,3-diol 53394021 Click to see COC1=C(C=C(C=C1)C=CC2=CC(=CC(=C2)O)O)O 258.27 unknown via CMAUP database
5-[(Z)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]benzene-1,3-diol 10879760 Click to see COC1=C(C=C(C=C1)C=CC2=CC(=CC(=C2)O)O)O 258.27 unknown via CMAUP database
cis-Stilbene 5356785 Click to see C1=CC=C(C=C1)C=CC2=CC=CC=C2 180.24 unknown via CMAUP database
Piceatannol 667639 Click to see C1=CC(=C(C=C1C=CC2=CC(=CC(=C2)O)O)O)O 244.24 unknown https://doi.org/10.1248/CPB.36.1545
Resveratrol 445154 Click to see C1=CC(=CC=C1C=CC2=CC(=CC(=C2)O)O)O 228.24 unknown via CMAUP database
Rhapontigenin 5320954 Click to see COC1=C(C=C(C=C1)C=CC2=CC(=CC(=C2)O)O)O 258.27 unknown via CMAUP database
trans-Stilbene 638088 Click to see C1=CC=C(C=C1)C=CC2=CC=CC=C2 180.24 unknown via CMAUP database
> Phenylpropanoids and polyketides / Stilbenes / Stilbene glycosides
(2S,3S,4S,5S,6S)-2-[3-hydroxy-5-[(E)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol 154497351 Click to see COC1=C(C=C(C=C1)C=CC2=CC(=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O 420.40 unknown https://doi.org/10.1016/S0031-9422(00)00341-1
(Z)-Rhaponticin 101535997 Click to see COC1=C(C=C(C=C1)C=CC2=CC(=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O 420.40 unknown via CMAUP database
[(2R,3S,4S,5R,6S)-6-[4-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]phenoxy]-3,4,5-trihydroxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate 5322088 Click to see C1=CC(=CC=C1C=CC2=CC(=CC(=C2)O)O)OC3C(C(C(C(O3)COC(=O)C4=CC(=C(C(=C4)O)O)O)O)O)O 542.50 unknown via CMAUP database
2-[3-Hydroxy-5-[2-(3-hydroxy-4-methoxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol 5062 Click to see COC1=C(C=C(C=C1)C=CC2=CC(=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O 420.40 unknown https://doi.org/10.1016/S0031-9422(00)00341-1
Resveratrol 4'-O-beta-D-(2''-O-galloyl)-glucopyranoside 10325054 Click to see C1=CC(=CC=C1C=CC2=CC(=CC(=C2)O)O)OC3C(C(C(C(O3)CO)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O 542.50 unknown via CMAUP database
resveratrol-4'-O-beta-d-glucopyranoside 54286634 Click to see C1=CC(=CC=C1C=CC2=CC(=CC(=C2)O)O)OC3C(C(C(C(O3)CO)O)O)O 390.40 unknown https://doi.org/10.1248/CPB.36.1545
Resveratroloside 5322089 Click to see C1=CC(=CC=C1C=CC2=CC(=CC(=C2)O)O)OC3C(C(C(C(O3)CO)O)O)O 390.40 unknown via CMAUP database
Rhapontin 637213 Click to see COC1=C(C=C(C=C1)C=CC2=CC(=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O 420.40 unknown via CMAUP database
> Phenylpropanoids and polyketides / Tannins
1-O,6-O-Digalloyl-2-O-cinnamoyl-beta-D-glucopyranose 6325082 Click to see C1=CC=C(C=C1)C=CC(=O)OC2C(C(C(OC2OC(=O)C3=CC(=C(C(=C3)O)O)O)COC(=O)C4=CC(=C(C(=C4)O)O)O)O)O 614.50 unknown via CMAUP database
1,2,6-Trigalloylglucose 440308 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)O 636.50 unknown via CMAUP database
1,6-bis-O-galloyl-beta-D-glucose 440221 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)O)O)O 484.40 unknown via CMAUP database
2-Cinnamoyl-1-galloylglucose 5315898 Click to see C1=CC=C(C=C1)C=CC(=O)OC2C(C(C(OC2OC(=O)C3=CC(=C(C(=C3)O)O)O)CO)O)O 462.40 unknown via CMAUP database
beta-Glucogallin 124021 Click to see C1=C(C=C(C(=C1O)O)O)C(=O)OC2C(C(C(C(O2)CO)O)O)O 332.26 unknown via CMAUP database
> Phenylpropanoids and polyketides / Tannins / Hydrolyzable tannins
1-O-Galloylpedunculagin 452242 Click to see C1C2C(C3C(C(O2)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5C6=C(C(=C(C=C6C(=O)O3)O)O)O)O)O)O)OC(=O)C7=CC(=C(C(=C7C8=C(C(=C(C=C8C(=O)O1)O)O)O)O)O)O 936.60 unknown via CMAUP database

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