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Pterocaulon virgatum

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Table of Contents

Details
Description
Synonyms
Common Names
Subtypes (subspecies, varieties, subvarieties, forms)
Germination/Propagation
Distribution
Links to other databases
Genome
Scientific Literature
Phytochemical Profile
Biological Material
Contributors
Collections

Details Top

Internal ID UUID643fd3e0a4d69637528509
Scientific name Pterocaulon virgatum
Authority (L.) DC.
First published in Prodr. 5: 454 (1836)

Description Top

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Synonyms Top

Scientific name Authority First published in
Gnaphalium decurrens Schrank Pl. Rar. Hort. Monac. t. 84.
Baccharis virgata Bojer ex DC. Prodr. 5: 385 (1836)
Pterocaulon subspicatum Malme Bull. Herb. Boissier ser. 2, 2: 388. 1902
Pluchea spicata Less. Syn. Gen. Compos. : 207 (1832)
Pterocaulon virgatum f. subvirgata (Malme) Arechav. Anales Mus. Nac. Montevideo 6: 269 (1908)
Chlaenobolus virgatus Cass. Dict. Sci. Nat., ed. 2. 49: 340 (1827)
Gnaphalium spicatum Mill. Gard. Dict. ed. 8 : n.° 24 (1768)
Pterocaulon pompilianum Standl. & L.O.Williams Ceiba 1: 94 (1950)
Gnaphalium virgatum L. Syst. Nat. ed. 10 2: 1211 (1759)
Pluchea virgata Less. Linnaea 6: 726 (1831)
Conyza virgata DC. Prodr. 5: 385 (1836)
Chlaenobolus spicatus Cass. Dict. Sci. Nat., ed. 2. 49: 341 (1827)
Conyza virgata L. Sp. Pl. ed. 2 2: 1206 (1763)
Pterocaulon spicatum DC. Prodr. 5: 454 (1836)
Pterocaulon pilcomayense Malme Repert. Spec. Nov. Regni Veg. 8: 73. 1910
Pterocaulon subspicatum Malme Bull. Herb. Boissier , ser. 2, 2: 388 (1902)
Conyza spicata Lam. Encycl. 2: 93 (1786)
Pterocaulon subvirgatum Malme Kongl. Svenska Vetensk. Acad. Handl. 32(5): 55 (1899)
Chlaenobolus virgata (L.) Cass. Dict. Sci. Nat., ed. 2. 49: 340 (1827)

Common names Top

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Language Common/alternative name
English wand blackroot

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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Forms (abbr. f.) Top

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No forms added yet.

Germination/Propagation Top

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No germination or propagation data was added yet.

Distribution (via POWO/KEW) Top

Legend for the distribution data:
- Doubtful data
- Extinct
- Introduced
- Native
  • Northern America
    • Mexico
      • Mexico Central
      • Mexico Gulf
      • Mexico Northeast
    • South-central U.S.A.
      • Texas
    • Southeastern U.S.A.
      • Alabama
      • Louisiana
  • Southern America
    • Brazil
      • Brazil Northeast
      • Brazil South
      • Brazil Southeast
      • Brazil West-central
    • Caribbean
      • Cuba
      • Dominican Republic
      • Haiti
      • Jamaica
      • Leeward Islands
      • Puerto Rico
    • Central America
      • Honduras
    • Southern South America
      • Argentina Northeast
      • Argentina Northwest
      • Paraguay
      • Uruguay
    • Western South America
      • Bolivia
      • Colombia

Links to other databases Top

Suggest others/fix!
Database ID/link to page
World Flora Online wfo-0000135734
USDA Plants PTVI2
Tropicos 2710904
INPN 919726
KEW urn:lsid:ipni.org:names:30022662-2
The Plant List gcc-96472
Open Tree Of Life 4727387
NCBI Taxonomy 1257061
Nature Serve 2.132268
IPNI 30022662-2
iNaturalist 167547
GBIF 5392236
Freebase /m/0_ljv6v
EPPO PTOVI
EOL 491967
USDA GRIN 455531
Wikipedia Pterocaulon_virgatum
CMAUP NPO9319

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
Helichrysum stoechas (L.) Moench Inflorescence Extract for Tomato Disease Management Sánchez-Hernández E, Álvarez-Martínez J, González-García V, Casanova-Gascón J, Martín-Gil J, Martín-Ramos P Molecules 03-Aug-2023
PMCID:PMC10421166
doi:10.3390/molecules28155861
PMID:37570830
Medicinal Plants from Latin America with Wound Healing Activity: Ethnomedicine, Phytochemistry, Preclinical and Clinical Studies—A Review Salazar-Gómez A, Alonso-Castro AJ Pharmaceuticals (Basel) 31-Aug-2022
PMCID:PMC9505834
doi:10.3390/ph15091095
PMID:36145316
Natural Coumarins: Exploring the Pharmacological Complexity and Underlying Molecular Mechanisms Sharifi-Rad J, Cruz-Martins N, López-Jornet P, Lopez EP, Harun N, Yeskaliyeva B, Beyatli A, Sytar O, Shaheen S, Sharopov F, Taheri Y, Docea AO, Calina D, Cho WC Oxid Med Cell Longev 23-Aug-2021
PMCID:PMC8440074
doi:10.1155/2021/6492346
PMID:34531939
Review on Natural Coumarin Lead Compounds for Their Pharmacological Activity Venugopala KN, Rashmi V, Odhav B Biomed Res Int 24-Mar-2013
PMCID:PMC3622347
doi:10.1155/2013/963248
PMID:23586066
Checklist of vascular plants of the Department of Ñeembucú, Paraguay Egea JD, Peña-Chocarro M, Espada C, Knapp S PhytoKeys 30-Jan-2012
PMCID:PMC3281576
doi:10.3897/phytokeys.9.2279
PMID:22371688
5-(3-Methyl-2-butenyloxy)-6,7-methylenedioxy-coumarin, a 5,6,7-Trioxygenated Coumarin from Pterocaulon virgatum Silvia L. Debenedetti, Patricia S. Palacios, Elena L. Nadinic, Jorge D. Coussio, Norbert De Kimpe, Marc Boeykens, Jeanine Feneau-Dupont, Jean-Paul Declercq American Chemical Society (ACS) 17-Mar-2005
doi:10.1021/NP50113A010
Structural revision of four coumarins from Pterocaulon species Silvia L. Debenedetti, Norbert De Kimpe, Marc Boeykens, Jorge D. Coussio, Bart Kesteleyn Elsevier BV 04-Mar-2003
doi:10.1016/S0031-9422(97)00174-X
Cuauthemone sesquiterpenoids from Blumea alata Ferdinand Bohlmann, Michael Wallmeyer, Jasmin Jakupovic, Thomas Gerke, Robert M. King, Harold Robinson Elsevier BV 25-Jul-2002
doi:10.1016/S0031-9422(00)80757-8
Caffeoylquinic acids from Pterocaulon virgatum and Pluchea sagittalis Virginia S. Martino, Silvia L. Debenedetti, Jorge D. Coussio Elsevier BV 25-Jul-2002
doi:10.1016/S0031-9422(00)82742-9
Isopurpurasol, a coumarin from Pterocaulon virgatum Silvia L Debenedetti, Kourosch Abbaspour Tehrani, Luc van Puyvelde, Norbert de Kimpe Elsevier BV 25-Jul-2002
doi:10.1016/S0031-9422(99)00087-4
Two 6,7-dioxygenated coumarins from Pterocaulon virgatum Silvia L. Debenedetti, Elena L. Nadinic, Jorge D. Coussio, Norbert De Kimpe, Marc Boeykens Elsevier BV 25-Jul-2002
doi:10.1016/S0031-9422(98)00020-X
Thiophene acetylenes and flavanols from Pterocaulon virgatum Ferdinand Bohlmann, Wolf-Rainer Abraham, Robert M. King, Harold Robinson Elsevier BV 25-Jul-2002
doi:10.1016/0031-9422(81)85187-4

Phytochemical Profile Top

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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 / Cyclohexylphenols
Secoabietane dialdehyde 15404650 Click to see CC(C)C1=C(C=C(C(=C1)C=O)C2(CCCC(C2C=O)(C)C)C)O 316.40 unknown via CMAUP database
> Lignans, neolignans and related compounds
(-)-Hinokiresinol 12310493 Click to see C=CC(C=CC1=CC=C(C=C1)O)C2=CC=C(C=C2)O 252.31 unknown via CMAUP database
3-[3-[(1R)-1-(Hydroxymethyl)-2-(3-methoxy-4-hydroxyphenyl)ethyl]-4-hydroxy-5-methoxyphenyl]-1-propanol tetraacetate 101932603 Click to see CC(=O)OCCCC1=CC(=C(C(=C1)OC)OC(=O)C)C(CC2=CC(=C(C=C2)OC(=O)C)OC)COC(=O)C 530.60 unknown via CMAUP database
Agatharesinol 15558522 Click to see C1=CC(=CC=C1C=CC(C2=CC=C(C=C2)O)C(CO)O)O 286.32 unknown via CMAUP database
Agatharesinol tetraacetate 101932604 Click to see CC(=O)OCC(C(C=CC1=CC=C(C=C1)OC(=O)C)C2=CC=C(C=C2)OC(=O)C)OC(=O)C 454.50 unknown via CMAUP database
Hydroxysugiresinol 12310688 Click to see C1C(C(COC1C2=CC=C(C=C2)O)O)C3=CC(=C(C=C3)O)O 302.32 unknown via CMAUP database
Sugiresinol 12443127 Click to see C1C(C(COC1C2=CC=C(C=C2)O)O)C3=CC=C(C=C3)O 286.32 unknown via CMAUP database
Trilobine 169007 Click to see CN1CCC2=CC3=C4C=C2C1CC5=CC(=C(C=C5)OC)OC6=CC=C(CC7C8=C(O4)C(=C(C=C8CCN7)OC)O3)C=C6 562.70 unknown via CMAUP database
> Lignans, neolignans and related compounds / Aryltetralin lignans
[(2R,3R,4S)-6-acetyloxy-4-(4-acetyloxy-3-methoxyphenyl)-3-(acetyloxymethyl)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methyl acetate 13831738 Click to see CC(=O)OCC1CC2=CC(=C(C=C2C(C1COC(=O)C)C3=CC(=C(C=C3)OC(=O)C)OC)OC(=O)C)OC 528.50 unknown via CMAUP database
> Lignans, neolignans and related compounds / Dibenzylbutane lignans
Secoisolariciresinol tetraacetate 14521049 Click to see CC(=O)OCC(CC1=CC(=C(C=C1)OC(=O)C)OC)C(CC2=CC(=C(C=C2)OC(=O)C)OC)COC(=O)C 530.60 unknown via CMAUP database
> Lignans, neolignans and related compounds / Furanoid lignans / Tetrahydrofuran lignans / 9,9-epoxylignans / Dibenzylbutyrolactone lignans
Matairesinol 119205 Click to see COC1=C(C=CC(=C1)CC2COC(=O)C2CC3=CC(=C(C=C3)O)OC)O 358.40 unknown via CMAUP database
Nortrachelogenin 394846 Click to see COC1=C(C=CC(=C1)CC2COC(=O)C2(CC3=CC(=C(C=C3)O)OC)O)O 374.40 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids
(+)-Copalol 10401988 Click to see CC(=CCO)CCC1C(=C)CCC2C1(CCCC2(C)C)C 290.50 unknown via CMAUP database
(13E)-15-Acetoxylabda-8,13-dien-19-oic acid 101675266 Click to see CC1=C(C2(CCCC(C2CC1)(C)C(=O)O)C)CCC(=CCOC(=O)C)C 362.50 unknown via CMAUP database
(13E)-15-Oxolabda-8(20),13-dien-19-oic acid 101675261 Click to see CC(=CC=O)CCC1C(=C)CCC2C1(CCCC2(C)C(=O)O)C 318.40 unknown via CMAUP database
(13E)-7beta-Acetoxy-15-hydroxylabda-8(20),13-dien-19-oic acid methyl ester 101675262 Click to see CC(=CCO)CCC1C(=C)C(CC2C1(CCCC2(C)C(=O)OC)C)OC(=O)C 392.50 unknown via CMAUP database
(13S)-13-Hydroxy-19-acetoxylabda-8(20),14-diene 101412320 Click to see CC(=O)OCC1(CCCC2(C1CCC(=C)C2CCC(C)(C=C)O)C)C 348.50 unknown via CMAUP database
(13S)-15-Hydroxylabd-8(20)-en-19-oic acid methyl ester 101987389 Click to see CC(CCC1C(=C)CCC2C1(CCCC2(C)C(=O)OC)C)CCO 336.50 unknown via CMAUP database
(13S)-Labd-8(20)-ene-15,19-dioic acid dimethyl ester 101987388 Click to see CC(CCC1C(=C)CCC2C1(CCCC2(C)C(=O)OC)C)CC(=O)OC 364.50 unknown via CMAUP database
(15E)-15-(2-Oxopropylidene)labd-8(20)-en-19-oic acid 101675260 Click to see CC(CCC1C(=C)CCC2C1(CCCC2(C)C(=O)O)C)CC=CC(=O)C 360.50 unknown via CMAUP database
(1R,4aR,4bS,7R,10aR)-7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carbaldehyde 12304199 Click to see CC1(CCC2C(=C1)CCC3C2(CCCC3(C)C=O)C)C=C 286.50 unknown via CMAUP database
(1S,4aR,5S,8aR)-Decahydro-5-[(3S)-3-hydroxy-3-methyl-4-penten-1-yl]-1,4a-dimethyl-6-methylene-1-naphthalenecarboxylic acid 73356501 Click to see CC12CCCC(C1CCC(=C)C2CCC(C)(C=C)O)(C)C(=O)O 320.50 unknown via CMAUP database
(1S)-1,2,3,4,4a,5,6,7,8,8abeta-Decahydro-1alpha,4abeta-dimethyl-6-methylene-5beta-[(3S)-3-methyl-5-oxohexyl]-1beta-naphthalenecarboxylic acid methyl ester 102239830 Click to see CC(CCC1C(=C)CCC2C1(CCCC2(C)C(=O)OC)C)CC(=O)C 348.50 unknown via CMAUP database
(4aS)-6-methoxy-1,1,4a-trimethyl-7-propan-2-yl-3,4-dihydro-2H-phenanthren-9-one 11312990 Click to see CC(C)C1=C(C=C2C(=C1)C(=O)C=C3C2(CCCC3(C)C)C)OC 312.40 unknown via CMAUP database
(4bS,8aR,9R)-4b,8,8-trimethyl-2-propan-2-yl-5,6,7,8a,9,10-hexahydrophenanthrene-3,9-diol 92446044 Click to see CC(C)C1=C(C=C2C(=C1)CC(C3C2(CCCC3(C)C)C)O)O 302.50 unknown via CMAUP database
(4bS,8aS,10S)-3,10-dimethoxy-4b,8,8-trimethyl-2-propan-2-yl-5,6,7,8a,9,10-hexahydrophenanthren-4-ol 21159045 Click to see CC(C)C1=C(C(=C2C(=C1)C(CC3C2(CCCC3(C)C)C)OC)O)OC 346.50 unknown via CMAUP database
(4bS,8aS,9R)-4b,8,8-trimethyl-2-propan-2-yl-5,6,7,8a,9,10-hexahydrophenanthrene-3,9-diol 14378752 Click to see CC(C)C1=C(C=C2C(=C1)CC(C3C2(CCCC3(C)C)C)O)O 302.50 unknown via CMAUP database
(5beta)-12-Methoxyabieta-6,8,11,13-tetrene 44423638 Click to see CC(C)C1=C(C=C2C(=C1)C=CC3C2(CCCC3(C)C)C)OC 298.50 unknown via CMAUP database
(5beta)-13-Isopropylpodocarpa-8,11,13-triene 15558805 Click to see CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)C)C 270.50 unknown via CMAUP database
(7R,8S)-7,8-Epoxy-6alpha-hydroxyabieta-9(11),13-dien-12-one 101664164 Click to see CC(C)C1=CC23C(O2)C(C4C(CCCC4(C3=CC1=O)C)(C)C)O 316.40 unknown via CMAUP database
11-Hydroxysugiol 10403490 Click to see CC(C)C1=C(C(=C2C(=C1)C(=O)CC3C2(CCCC3(C)C)C)O)O 316.40 unknown via CMAUP database
11-Methoxy-12-hydroxyabieta-8,11,13-trien-7-one 56683169 Click to see CC(C)C1=C(C(=C2C(=C1)C(=O)CC3C2(CCCC3(C)C)C)OC)O 330.50 unknown via CMAUP database
12-Methoxyabieta-6,8,11,13-tetrene 11266522 Click to see CC(C)C1=C(C=C2C(=C1)C=CC3C2(CCCC3(C)C)C)OC 298.50 unknown via CMAUP database
13-Epimanool 10891602 Click to see CC1(CCCC2(C1CCC(=C)C2CCC(C)(C=C)O)C)C 290.50 unknown via CMAUP database
13-Epitorulosol 12444402 Click to see CC1(CCCC2(C1CCC(=C)C2CCC(C)(C=C)O)C)CO 306.50 unknown via CMAUP database
13-Methyl-13-hydroxy-13,14-seco-17-norabieta-8(14),15-diene-19-al 101274319 Click to see CC1(CCCC2(C1CCC(=C)C2CCC(C)(C=C)O)C)C=O 304.50 unknown via CMAUP database
14-Hydroxy-15-norlabd-8(20)-en-19-oic acid methyl ester 101675263 Click to see CC(CCC1C(=C)CCC2C1(CCCC2(C)C(=O)OC)C)CO 322.50 unknown via CMAUP database
15-Acetoxyisocupressic acid 14287147 Click to see CC(=CCOC(=O)C)CCC1C(=C)CCC2C1(CCCC2(C)C(=O)O)C 362.50 unknown via CMAUP database
19-[[(E)-3-(4-Methoxyphenyl)propenoyl]oxy]labda-13(16),14-dien-8-ol 101675267 Click to see CC1(CCCC2(C1CCC(C2CCC(=C)C=C)(C)O)C)COC(=O)C=CC3=CC=C(C=C3)OC 466.70 unknown via CMAUP database
19-Hydroxyferruginol 21632843 Click to see CC(C)C1=C(C=C2C(=C1)CCC3C2(CCCC3(C)CO)C)O 302.50 unknown via CMAUP database
2,3-Dehydroferruginol 14038046 Click to see CC(C)C1=C(C=C2C(=C1)CCC3C2(CC=CC3(C)C)C)O 284.40 unknown via CMAUP database
2,6,6-Trimethyl-2beta-[2-[(S)-[(12-hydroxyabieta-8,11,13-triene-6alpha,7beta-diyl)bisoxy]methyl]-4-isopropyl-5-hydroxyphenyl]cyclohexane-1alpha-carbaldehyde 15346573 Click to see CC(C)C1=C(C=C2C(=C1)C3C(C4C2(CCCC4(C)C)C)OC(O3)C5=CC(=C(C=C5C6(CCCC(C6C=O)(C)C)C)O)C(C)C)O 616.90 unknown via CMAUP database
6-Hydroxy-5,6-dehydrosugiol 3009284 Click to see CC(C)C1=C(C=C2C(=C1)C(=O)C(=C3C2(CCCC3(C)C)C)O)O 314.40 unknown via CMAUP database
6-Hydroxysugiol 12114761 Click to see CC(C)C1=C(C=C2C(=C1)C(=O)C(C3C2(CCCC3(C)C)C)O)O 316.40 unknown via CMAUP database
6,12-Dihydroxy-11-methoxyabieta-5,8,11,13-tetren-7-one 101687163 Click to see CC(C)C1=C(C(=C2C(=C1)C(=O)C(=C3C2(CCCC3(C)C)C)O)OC)O 344.40 unknown via CMAUP database
6,12,15-Trihydroxyabieta-5,8,11,13-tetrene-7-one 15480773 Click to see CC1(CCCC2(C1=C(C(=O)C3=CC(=C(C=C32)O)C(C)(C)O)O)C)C 330.40 unknown via CMAUP database
6,7-Dehydroferruginol 10978982 Click to see CC(C)C1=C(C=C2C(=C1)C=CC3C2(CCCC3(C)C)C)O 284.40 unknown via CMAUP database
6alpha-Hydroxydemethylcryptojaponol 76326386 Click to see CC(C)C1=C(C(=C2C(=C1)C(=O)C(C3C2(CCCC3(C)C)C)O)O)O 332.40 unknown via CMAUP database
6alpha,11-Dihydroxy-12-methoxyabieta-8,11,13-trien-7-one 101687162 Click to see CC(C)C1=C(C(=C2C(=C1)C(=O)C(C3C2(CCCC3(C)C)C)O)O)OC 346.50 unknown via CMAUP database
7-Dehydroabietanone 11289118 Click to see CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2=O)(C)C)C 284.40 unknown via CMAUP database
8-Hydroxyabieta-9(11),13-diene-12-one 44427460 Click to see CC(C)C1=CC2(CCC3C(CCCC3(C2=CC1=O)C)(C)C)O 302.50 unknown via CMAUP database
9,10-Phenanthrenedione, 1,2,3,4,4a,10a-hexahydro-6-hydroxy-1,1,4a-trimethyl-7-(1-methylethyl)-, (4aS-cis)- 12114762 Click to see CC(C)C1=C(C=C2C(=C1)C(=O)C(=O)C3C2(CCCC3(C)C)C)O 314.40 unknown via CMAUP database
Abieta-7,13-diene 443470 Click to see CC(C)C1=CC2=CCC3C(CCCC3(C2CC1)C)(C)C 272.50 unknown via CMAUP database
Abietatriene 6432211 Click to see CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)C)C 270.50 unknown via CMAUP database
Acetylimbricatolic acid 38359540 Click to see CC(CCC1C(=C)CCC2C1(CCCC2(C)C(=O)O)C)CCOC(=O)C 364.50 unknown via CMAUP database
Agathadiol 15558517 Click to see CC(=CCO)CCC1C(=C)CCC2C1(CCCC2(C)CO)C 306.50 unknown via CMAUP database
Agathadiol diacetate 91884742 Click to see CC(=CCOC(=O)C)CCC1C(=C)CCC2C1(CCCC2(C)COC(=O)C)C 390.60 unknown via CMAUP database
Agatholal 15559800 Click to see CC(=CCO)CCC1C(=C)CCC2C1(CCCC2(C)C=O)C 304.50 unknown via CMAUP database
cis-Ferruginol 91747538 Click to see CC(C)C1=C(C=C2C(=C1)CCC3C2(CCCC3(C)C)C)O 286.50 unknown via CMAUP database
Communic Acid 637125 Click to see CC(=CCC1C(=C)CCC2C1(CCCC2(C)C(=O)O)C)C=C 302.50 unknown via CMAUP database
Cryptojaponol 11724205 Click to see CC(C)C1=C(C(=C2C(=C1)C(=O)CC3C2(CCCC3(C)C)C)O)OC 330.50 unknown via CMAUP database
Cryptoquinone 11243941 Click to see CC(C)C1=CC(=O)C2=C(C1=O)C(=O)CC3C2(CCCC3(C)C)C 314.40 unknown via CMAUP database
Cryptoquinonemethide D 101637222 Click to see CC(C)C1=C2C3=C(CC4C(CCCC4(C3=C(C1=O)O)C)(C)C)C(C25CCC6(C5C6)C(C)C)O 450.70 unknown via CMAUP database
Cryptotrione 46844522 Click to see CC(C)C1=C2C3=C(CC4C(CCCC4(C3=C(C1=O)O)C)(C)C)C(=O)C25CCC6C5C6C(CCC(=O)C)C(C)C 532.80 unknown via CMAUP database
Elliotinoic acid 12303814 Click to see CC(=CCC1C(=C)CCC2C1(CCCC2(C)C(=O)O)C)C=C 302.50 unknown via CMAUP database
Ent-sandaracopimaradiene 12314278 Click to see CC1(CCCC2(C1CCC3=CC(CCC32)(C)C=C)C)C 272.50 unknown via CMAUP database
Ferrugicadinol 11562492 Click to see CC(C)C1CCC(C2C1C=C(CC2)CC3CC4C(CCCC4(C5=CC(=C(C=C35)C(C)C)O)C)(C)C)(C)O 506.80 unknown via CMAUP database
Ferruginol 442027 Click to see CC(C)C1=C(C=C2C(=C1)CCC3C2(CCCC3(C)C)C)O 286.50 unknown via CMAUP database
Formosaninol 10722301 Click to see CC(C)C1=C(C=C2C(=C1)C3C(C4C2(CCCC4(C)C)C)OC5C(O3)C6C(CCCC6(C7=CC(=C(C=C57)C(C)C)O)C)(C)C)O 600.90 unknown via CMAUP database
Hinokiol 12310492 Click to see CC(C)C1=C(C=C2C(=C1)CCC3C2(CCC(C3(C)C)O)C)O 302.50 unknown via CMAUP database
Imbricatolic Acid 70688370 Click to see CC(CCC1C(=C)CCC2C1(CCCC2(C)C(=O)O)C)CCO 322.50 unknown via CMAUP database
Isochamaecydin 101637220 Click to see CC(C)C1=C2C3=C(CC4C(CCCC4(C3=C(C1=O)O)C)(C)C)C(=O)C25CCC6(C5C6)C(C)C 448.60 unknown via CMAUP database
Isocupressic acid 6438138 Click to see CC(=CCO)CCC1C(=C)CCC2C1(CCCC2(C)C(=O)O)C 320.50 unknown via CMAUP database
Isopimaric acid 442048 Click to see CC1(CCC2C(=CCC3C2(CCCC3(C)C(=O)O)C)C1)C=C 302.50 unknown via CMAUP database
Isopimarinol 15586712 Click to see CC1(CCC2C(=CCC3C2(CCCC3(C)CO)C)C1)C=C 288.50 unknown via CMAUP database
Junicedric acid 38347252 Click to see CC(CCC1C(=C)CCC2C1(CCCC2(C)C(=O)O)C)CC(=O)O 336.50 unknown via CMAUP database
Lmfyrqdvrpkepm-ywzlykjasa- 10543461 Click to see CC(C)C1=CC(=C2C(=C1O)C(=O)CC3C2(CCCC3(C)C)C)O 316.40 unknown via CMAUP database
Nezukol 13969544 Click to see CC1(CCCC2(C1CCC3(C2CCC(C3)(C)C=C)O)C)C 290.50 unknown via CMAUP database
Sandaracopimaric acid 221580 Click to see CC1(CCC2C(=C1)CCC3C2(CCCC3(C)C(=O)O)C)C=C 302.50 unknown via CMAUP database
Sandaracopimarinol 12314286 Click to see CC1(CCC2C(=C1)CCC3C2(CCCC3(C)CO)C)C=C 288.50 unknown via CMAUP database
Sclarene 11323257 Click to see CC1(CCCC2(C1CCC(=C)C2CCC(=C)C=C)C)C 272.50 unknown via CMAUP database
Sugikurojin A 12116652 Click to see CC(C)C1=C(C=C2C(=C1)C=CC3C2(CCCC3(C)CO)C)O 300.40 unknown via CMAUP database
Sugikurojin B 23250764 Click to see CC(C)C1=C(C=C2C(=C1)C=CC3C2(CCCC3(C)C)C)OC4C(C5=CC(=C(C=C5C6(C4C(CCC6)(C)C)C)O)C(C)C)OC 598.90 unknown via CMAUP database
Sugikurojin C 101334078 Click to see CC(C)C1=C(C=C2C(=C1)C3C(C4C2(CCCC4(C)C)C)OC5C(O3)C6C(CCCC6(C7=CC(=C(C=C57)C(C)C)O)C)(C)C)O 600.90 unknown via CMAUP database
Sugikurojin D 11661100 Click to see CC(C)C1=C(C(=C2C(=C1)C(C(C3C2(CCCC3(C)C)C)OC(=O)C)O)O)OC 390.50 unknown via CMAUP database
Sugikurojin E 11624685 Click to see CC(C)C1=C(C=C2C(=C1)C(C(C3C2(CCCC3(C)C)C)OC(=O)C)O)O 360.50 unknown via CMAUP database
Sugikurojin F 11566133 Click to see CC(C)C1=CC2=C(C(=O)C1=O)C3(CCCC(C3CC2OC)(C)C)C 330.50 unknown via CMAUP database
Sugikurojin H 11584453 Click to see CC(C)C1CCC(C2(C1C=C(CC2)CC3CC4C(CCCC4(C5=CC(=C(C=C35)C(C)C)O)C)(C)C)O)(C)O 522.80 unknown via CMAUP database
Sugikurojin J 11549006 Click to see CC(C)C1=C(C=C2C(=C1)C(CC3C2(CCCC3(C)C)C)OOC(=O)C4(CCCC5(C4CC(=O)C6=CC(CCC65)(C)C=C)C)C)O 616.90 unknown via CMAUP database
Sugiol 94162 Click to see CC(C)C1=C(C=C2C(=C1)C(=O)CC3C2(CCCC3(C)C)C)O 300.40 unknown via CMAUP database
Sugiol methyl ether 11186112 Click to see CC(C)C1=C(C=C2C(=C1)C(=O)CC3C2(CCCC3(C)C)C)OC 314.50 unknown via CMAUP database
Totarol 92783 Click to see CC(C)C1=C(C=CC2=C1CCC3C2(CCCC3(C)C)C)O 286.50 unknown via CMAUP database
Xanthoperol 12305710 Click to see CC(C)C1=C(C=C2C(=C1)C(=O)C(=O)C3C2(CCCC3(C)C)C)O 314.40 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Acyclic diterpenoids
Phytol 5280435 Click to see CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C 296.50 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Colensane and clerodane diterpenoids
15,16-Epoxylabda-13(16),14-diene-8,19-diol 101675265 Click to see CC1(CCCC2(C1CCC(C2CCC3=COC=C3)(C)O)C)CO 320.50 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Kaurane diterpenoids
(+)-Isokaurene 101297738 Click to see CC1=CC23CCC4C(CCCC4(C2CCC1C3)C)(C)C 272.50 unknown via CMAUP database
(15S,16R)-15-(Hydroxymethyl)-16-hydroxy-17-methylkauran-17-one 101664167 Click to see CC(=O)C1(C2CCC3C4(CCCC(C4CCC3(C2)C1CO)(C)C)C)O 348.50 unknown via CMAUP database
(1S,4S,9S,10S,13R,14R)-5,5,9,14-tetramethyltetracyclo[11.2.1.01,10.04,9]hexadecan-14-ol 101306763 Click to see CC1(CCCC2(C1CCC34C2CCC(C3)C(C4)(C)O)C)C 290.50 unknown via CMAUP database
[(1S,4R,9R,10S,13R)-5,5,9-Trimethyl-14-tetracyclo[11.2.1.01,10.04,9]hexadec-14-enyl]methanol 21670065 Click to see CC1(CCCC2(C1CCC34C2CCC(C3)C(=C4)CO)C)C 288.50 unknown via CMAUP database
ent-Kauran-16-beta-ol 21593607 Click to see CC1(CCCC2(C1CCC34C2CCC(C3)C(C4)(C)O)C)C 290.50 unknown via CMAUP database
ent-Kaurene 11966109 Click to see CC1(CCCC2(C1CCC34C2CCC(C3)C(=C)C4)C)C 272.50 unknown via CMAUP database
Kaur-15-en-17-al 101664166 Click to see CC1(CCCC2(C1CCC34C2CCC(C3)C(=C4)C=O)C)C 286.50 unknown via CMAUP database
Phyllocladene 101289537 Click to see CC1(CCCC2(C1CCC34C2CCC(C3)C(=C)C4)C)C 272.50 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids
12-Methoxy-6,7-secoabieta-8,11,13-triene-6,7-dial 101664165 Click to see CC(C)C1=C(C=C(C(=C1)C=O)C2(CCCC(C2C=O)(C)C)C)OC 330.50 unknown via CMAUP database
2,5-Dimethoxy-p-cymene 6427071 Click to see CC1=CC(=C(C=C1OC)C(C)C)OC 194.27 unknown https://doi.org/10.1016/S0031-9422(00)80757-8
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids
(+)-alpha-Pinene 82227 Click to see CC1=CCC2CC1C2(C)C 136.23 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids
(+)-Isomenthone 70962 Click to see CC1CCC(C(=O)C1)C(C)C 154.25 unknown via CMAUP database
(2R,5R)-5-(2-hydroxypropan-2-yl)-2-methyl-2-(4-oxopentyl)cyclohexan-1-one 11172838 Click to see CC(=O)CCCC1(CCC(CC1=O)C(C)(C)O)C 254.36 unknown via CMAUP database
Gleenol 6429080 Click to see CC1CCC(C(C12CCC(=C2)C)O)C(C)C 222.37 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
(+)-Calamenene 11298625 Click to see CC1CCC(C2=C1C=CC(=C2)C)C(C)C 202.33 unknown via CMAUP database
(+)-delta-Cadinene 441005 Click to see CC1=CC2C(CCC(=C2CC1)C)C(C)C 204.35 unknown via CMAUP database
(+)-Epijuvabione 10923485 Click to see CC(C)CC(=O)CC(C)C1CCC(=CC1)C(=O)OC 266.38 unknown via CMAUP database
(1aR,2S,4aS,8aS)-2,4a,8,8-tetramethyl-1a,3,4,5,6,7-hexahydro-1H-cyclopropa[j]naphthalen-2-ol 15241194 Click to see CC1(CCCC2(C13CC3C(CC2)(C)O)C)C 222.37 unknown via CMAUP database
(1E,6E)-gamma-humulene 6365330 Click to see CC1=CCCC(=C)C=CC(CCC1)(C)C 204.35 unknown https://doi.org/10.1016/0031-9422(81)85187-4
(1R)-4,7-Dimethyl-1-(propan-2-yl)-1,2-dihydronaphthalene 71353669 Click to see CC1=CCC(C2=C1C=CC(=C2)C)C(C)C 200.32 unknown via CMAUP database
(1S,6R)-2,7(14),10-Bisabolatrien-1-ol-4-one 52918088 Click to see CC1=CC(C(CC1=O)C(=C)CCC=C(C)C)O 234.33 unknown via CMAUP database
(1Z,6E)-gamma-humulene 14038477 Click to see CC1=CCCC(=C)C=CC(CCC1)(C)C 204.35 unknown https://doi.org/10.1016/S0031-9422(00)80757-8
(4S,6E)-4-hydroxy-3-methyl-6-(6-methylhept-5-en-2-ylidene)cyclohex-2-en-1-one 10059937 Click to see CC1=CC(=O)C(=C(C)CCC=C(C)C)CC1O 234.33 unknown via CMAUP database
(R)-beta-bisabolene 68128 Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C 204.35 unknown https://doi.org/10.1016/S0031-9422(00)80757-8
1-Methoxy-4-cadinene 11447728 Click to see CC1CCC(C2C1(CCC(=C2)C)OC)C(C)C 236.39 unknown via CMAUP database
15,16-Dinor-13-oxolabda-8(17)-ene-19-oic acid methyl ester 11255232 Click to see CC(=O)CCC1C(=C)CCC2C1(CCCC2(C)C(=O)OC)C 306.40 unknown via CMAUP database
alpha-Cadinol 10398656 Click to see CC1=CC2C(CCC(C2CC1)(C)O)C(C)C 222.37 unknown via CMAUP database
alpha-Muurolene 12306047 Click to see CC1=CC2C(CC1)C(=CCC2C(C)C)C 204.35 unknown via CMAUP database
beta-Bisabolene 10104370 Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C 204.35 unknown https://doi.org/10.1016/S0031-9422(00)80757-8
Bisabola-1,7(14),10-trien-1-ol-4-one 101234104 Click to see CC1=CC(C(CC1=O)C(=C)CCC=C(C)C)O 234.33 unknown via CMAUP database
Calamenene 6429077 Click to see CC1CCC(C2=C1C=CC(=C2)C)C(C)C 202.33 unknown via CMAUP database
Cedrelanol 160799 Click to see CC1=CC2C(CCC(C2CC1)(C)O)C(C)C 222.37 unknown via CMAUP database
Cryptomerione 11964091 Click to see CC1=CCC(CC1=O)C(=C)CCC=C(C)C 218.33 unknown via CMAUP database
Cryptomerone 101297688 Click to see CC1=CC(C(CC1=O)C(=C)CCCC(C)(C)O)O 252.35 unknown via CMAUP database
Cubebol 11276107 Click to see CC1CCC(C2C13C2C(CC3)(C)O)C(C)C 222.37 unknown via CMAUP database
Cubenol 11770062 Click to see CC1CCC(C2C1(CCC(=C2)C)O)C(C)C 222.37 unknown via CMAUP database
Epicubenol 12046149 Click to see CC1CCC(C2C1(CCC(=C2)C)O)C(C)C 222.37 unknown via CMAUP database
Epitodomatuic acid 12444430 Click to see CC(C)CC(=O)CC(C)C1CCC(=CC1)C(=O)O 252.35 unknown via CMAUP database
gamma-Humulene 3015263 Click to see CC1=CCCC(=C)C=CC(CCC1)(C)C 204.35 unknown https://doi.org/10.1016/0031-9422(81)85187-4
Oplodiol 12313756 Click to see CC(C)C1=CCC2(C(CCC(C2C1)(C)O)O)C 238.37 unknown via CMAUP database
Oplopanone 10466745 Click to see CC(C)C1CCC(C2C1C(CC2)C(=O)C)(C)O 238.37 unknown via CMAUP database
Torreyol 11990360 Click to see CC1=CC2C(CCC(C2CC1)(C)O)C(C)C 222.37 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Cedrane and isocedrane sesquiterpenoids
(1S,2R,5R,7R,8R)-2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undecan-8-ol 7076489 Click to see CC1CCC2C13CCC(C(C3)C2(C)C)(C)O 222.37 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Elemane sesquiterpenoids
1-Elemen-4,11-diol 15767775 Click to see CC1(CCC(CC1C(C)(C)O)C(C)(C)O)C=C 240.38 unknown via CMAUP database
Elemol 92138 Click to see CC(=C)C1CC(CCC1(C)C=C)C(C)(C)O 222.37 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids
(+)-5-Epieudesmane-4alpha,11-diol 21595528 Click to see CC12CCCC(C1CC(CC2)C(C)(C)O)(C)O 240.38 unknown via CMAUP database
(1S,4aR,7R,8aR)-7-(1-hydroxy-1-methyl-ethyl)-1,4a-dimethyl-decalin-1-ol 11184061 Click to see CC12CCCC(C1CC(CC2)C(C)(C)O)(C)O 240.38 unknown via CMAUP database
11beta-Acetoxyselin-4alpha-ol 10660570 Click to see CC(=O)OC(C)(C)C1CCC2(CCCC(C2C1)(C)O)C 282.40 unknown via CMAUP database
1beta-Acetoxy-3-eudesmen-11-ol 101928775 Click to see CC1=CCC(C2(C1CC(CC2)C(C)(C)O)C)OC(=O)C 280.40 unknown via CMAUP database
1beta-Acetoxy-4-eudesmen-11-ol 101928776 Click to see CC1=C2CC(CCC2(C(CC1)OC(=O)C)C)C(C)(C)O 280.40 unknown via CMAUP database
1beta-Acetoxy-4(15)-eudesmen-11-ol 101928777 Click to see CC(=O)OC1CCC(=C)C2C1(CCC(C2)C(C)(C)O)C 280.40 unknown via CMAUP database
1beta-Hydroxy-beta-eudesmol 13969455 Click to see CC12CCC(CC1C(=C)CCC2O)C(C)(C)O 238.37 unknown via CMAUP database
3-Eudesmene-1beta,11-diol 101928774 Click to see CC1=CCC(C2(C1CC(CC2)C(C)(C)O)C)O 238.37 unknown via CMAUP database
4-Eudesmene-1beta,11-diol 11356850 Click to see CC1=C2CC(CCC2(C(CC1)O)C)C(C)(C)O 238.37 unknown via CMAUP database
7-epi-4-Eudesmene-1beta,11-diol 15767776 Click to see CC1=C2CC(CCC2(C(CC1)O)C)C(C)(C)O 238.37 unknown via CMAUP database
7-epi-gamma-Eudesmol 6428429 Click to see CC1=C2CC(CCC2(CCC1)C)C(C)(C)O 222.37 unknown via CMAUP database
alpha-Eudesmol 92762 Click to see CC1=CCCC2(C1CC(CC2)C(C)(C)O)C 222.37 unknown via CMAUP database
beta-EUDESMOL 91457 Click to see CC12CCCC(=C)C1CC(CC2)C(C)(C)O 222.37 unknown via CMAUP database
Eudesmane-5alpha,11-diol 101928773 Click to see CC1CCCC2(C1(CC(CC2)C(C)(C)O)O)C 240.38 unknown via CMAUP database
gamma-EUDESMOL 6432005 Click to see CC1=C2CC(CCC2(CCC1)C)C(C)(C)O 222.37 unknown via CMAUP database
Proximadiol 165258 Click to see CC12CCCC(C1CC(CC2)C(C)(C)O)(C)O 240.38 unknown via CMAUP database
Voleneol 14137570 Click to see CC(C)C1CCC2(C(CCC(=C)C2C1O)O)C 238.37 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Germacrane sesquiterpenoids
(2E,6E)-hedycaryol 10998630 Click to see CC1=CCCC(=CCC(CC1)C(C)(C)O)C 222.37 unknown via CMAUP database
Germacra-1(10),5-dien-4beta-ol 11148775 Click to see CC1=CCCC(C=CC(CC1)C(C)C)(C)O 222.37 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Himachalane and lippifoliane sesquiterpenoids
gamma-Himachalene 577062 Click to see CC1=CC2C(CC1)C(=CCCC2(C)C)C 204.35 unknown https://doi.org/10.1016/S0031-9422(00)80757-8
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Diterpene glycosides
(8alpha,9S,10beta,13Z)-15,16-Diacetoxycleroda-3,13-diene-19-oic acid 2-O,3-O,4-O,6-O-tetraacetyl-beta-D-galactopyranosyl ester 6324932 Click to see CC1CCC2(C(C1(C)CCC(=CCOC(=O)C)COC(=O)C)CCC=C2C(=O)OC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)C 750.80 unknown via CMAUP database
(8alpha,9S,10beta,13Z)-19-(2-O,3-O,4-O,6-O-Tetraacetyl-beta-D-galactopyranosyloxy)-16-hydroxy-19-oxocleroda-3,13-diene-15-oic acid 15,16-lactone 6324933 Click to see CC1CCC2(C(C1(C)CCC3=CC(=O)OC3)CCC=C2C(=O)OC4C(C(C(C(O4)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)C 662.70 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
(18alpha,19alpha)-5alpha-Urs-20(30)-en-3-one 14485466 Click to see CC1C2C3CCC4C5(CCC(=O)C(C5CCC4(C3(CCC2(CCC1=C)C)C)C)(C)C)C 424.70 unknown https://doi.org/10.1016/0031-9422(81)85187-4
4,4,6a,6b,8a,12,14b-Heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-ol 610148 Click to see CC1C2C3CCC4C5(CCC(C(C5CCC4(C3(CCC2(CCC1=C)C)C)C)(C)C)O)C 426.70 unknown https://doi.org/10.1016/0031-9422(81)85187-4
Taraxasterol 115250 Click to see CC1C2C3CCC4C5(CCC(C(C5CCC4(C3(CCC2(CCC1=C)C)C)C)(C)C)O)C 426.70 unknown https://doi.org/10.1016/0031-9422(81)85187-4
Taraxasterol acetate 13889352 Click to see CC1C2C3CCC4C5(CCC(C(C5CCC4(C3(CCC2(CCC1=C)C)C)C)(C)C)OC(=O)C)C 468.80 unknown https://doi.org/10.1016/0031-9422(81)85187-4
Taraxasterol, acetate 344468 Click to see CC1C2C3CCC4C5(CCC(C(C5CCC4(C3(CCC2(CCC1=C)C)C)C)(C)C)OC(=O)C)C 468.80 unknown https://doi.org/10.1016/0031-9422(81)85187-4
Taraxasterone 14485465 Click to see CC1C2C3CCC4C5(CCC(=O)C(C5CCC4(C3(CCC2(CCC1=C)C)C)C)(C)C)C 424.70 unknown https://doi.org/10.1016/0031-9422(81)85187-4
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives
(1S,3R,4S,5R)-3-[(Z)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid 6604240 Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O 354.31 unknown https://doi.org/10.1016/S0031-9422(99)00087-4
[1S-(1alpha,3beta,4beta,5alpha)]-3-[[3-(3,4-dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexanecarboxylic acid 6436237 Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O 354.31 unknown https://doi.org/10.1016/S0031-9422(99)00087-4
1,3,4,5-Tetrahydroxycyclohexanecarboxylic acid 1064 Click to see C1C(C(C(CC1(C(=O)O)O)O)O)O 192.17 unknown https://doi.org/10.1016/S0031-9422(00)82742-9
4,5-Dicaffeoylquinic acid 5281780 Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O 516.40 unknown https://doi.org/10.1016/S0031-9422(99)00087-4
Chlorogenic Acid 1794427 Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O 354.31 unknown https://doi.org/10.1016/S0031-9422(99)00087-4
Quinic acid 6508 Click to see C1C(C(C(CC1(C(=O)O)O)O)O)O 192.17 unknown https://doi.org/10.1016/S0031-9422(00)82742-9
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Shikimic acids and derivatves
Shikimic acid 8742 Click to see C1C(C(C(C=C1C(=O)O)O)O)O 174.15 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Tertiary alcohols
(1R,4aR,7R,8aR)-7-(2-hydroxypropan-2-yl)-4a-methyl-2,3,4,5,6,7,8,8a-octahydro-1H-naphthalen-1-ol 92530569 Click to see CC12CCCC(C1CC(CC2)C(C)(C)O)O 226.35 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides
Lavandoside 13916049 Click to see COC1=C(C=CC(=C1)C=CC(=O)O)OC2C(C(C(C(O2)CO)O)O)O 356.32 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Benzaldehydes / Hydroxybenzaldehydes
4-Hydroxybenzaldehyde 126 Click to see C1=CC(=CC=C1C=O)O 122.12 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones
8,13-Dioxo-15,16,20-trinorlabdan-19-oic acid 101687161 Click to see CC(=O)CCC1C(=O)CCC2C1(CCCC2(C)C(=O)O)C 294.40 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones
17-Norkauran-16-one 12112097 Click to see CC1(CCCC2(C1CCC34C2CCC(C3)C(=O)C4)C)C 274.40 unknown via CMAUP database
> Organoheterocyclic compounds / Benzofurans
2-(3-Methyl-2-butenyl)-3,6-dimethylbenzofuran-5-ol 10398970 Click to see CC1=CC2=C(C=C1O)C(=C(O2)CC=C(C)C)C 230.30 unknown via CMAUP database
> Organoheterocyclic compounds / Benzopyrans / 2-benzopyrans
(4aR,10bR)-4a,9-dihydroxy-4,4,10b-trimethyl-8-propan-2-yl-2,3-dihydro-1H-benzo[c]chromen-6-one 59163243 Click to see CC(C)C1=C(C=C2C(=C1)C(=O)OC3(C2(CCCC3(C)C)C)O)O 318.40 unknown via CMAUP database
> Organoheterocyclic compounds / Bi- and oligothiophenes
(2R)-1-chloro-4-[5-(5-methylthiophen-2-yl)thiophen-2-yl]but-3-yn-2-ol 163186362 Click to see CC1=CC=C(S1)C2=CC=C(S2)C#CC(CCl)O 282.80 unknown https://doi.org/10.1016/0031-9422(81)85187-4
(2S)-1-chloro-4-(5-thiophen-2-ylthiophen-2-yl)but-3-yn-2-ol 162853513 Click to see C1=CSC(=C1)C2=CC=C(S2)C#CC(CCl)O 268.80 unknown https://doi.org/10.1016/0031-9422(81)85187-4
1-Chloro-4-[5-(5-methylthiophen-2-yl)thiophen-2-yl]but-3-yn-2-ol 162867420 Click to see CC1=CC=C(S1)C2=CC=C(S2)C#CC(CCl)O 282.80 unknown https://doi.org/10.1016/0031-9422(81)85187-4
5-(4-Chloro-3-hydroxy-1-butynyl)-2,2'-bithiophene 85528914 Click to see C1=CSC(=C1)C2=CC=C(S2)C#CC(CCl)O 268.80 unknown https://doi.org/10.1016/0031-9422(81)85187-4
> Organoheterocyclic compounds / Thiophenes / 2,5-disubstituted thiophenes
(2S)-1-chloro-4-(5-penta-1,3-diynylthiophen-2-yl)but-3-yn-2-ol 86310851 Click to see CC#CC#CC1=CC=C(S1)C#CC(CCl)O 248.73 unknown https://doi.org/10.1016/0031-9422(81)85187-4
1-Chloro-4-(5-(penta-1,3-diyn-1-yl)thiophen-2-yl)but-3-yn-2-ol 5315834 Click to see CC#CC#CC1=CC=C(S1)C#CC(CCl)O 248.73 unknown https://doi.org/10.1016/0031-9422(81)85187-4
> Phenylpropanoids and polyketides / 2-arylbenzofuran flavonoids
(2S,3S)-2,3-Dihydro-2alpha-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-5-benzofuran-1-propanol triacetate 101932602 Click to see CC(=O)OCCCC1=CC2=C(C(=C1)OC)OC(C2COC(=O)C)C3=CC(=C(C=C3)OC(=O)C)OC 486.50 unknown via CMAUP database
Cedrunsin tetraacetate 21722964 Click to see CC(=O)OCCCC1=CC2=C(C(=C1)OC(=O)C)OC(C2COC(=O)C)C3=CC(=C(C=C3)OC(=O)C)OC 514.50 unknown via CMAUP database
Cedrusinin triacetate 101932601 Click to see CC(=O)OCCCC1=CC2=C(C=C1)OC(C2COC(=O)C)C3=CC(=C(C=C3)OC(=O)C)OC 456.50 unknown via CMAUP database
Dihydrodehydrodiconiferyl alcohol triacetate 14542812 Click to see CC(=O)OCCCC1=CC2=C(C(=C1)OC)OC(C2COC(=O)C)C3=CC(=C(C=C3)OC(=O)C)OC 486.50 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 https://doi.org/10.1016/S0031-9422(99)00087-4
Ferulic acid 445858 Click to see COC1=C(C=CC(=C1)C=CC(=O)O)O 194.18 unknown via CMAUP database
p-Coumaric acid 637542 Click to see C1=CC(=CC=C1C=CC(=O)O)O 164.16 unknown via CMAUP database
> Phenylpropanoids and polyketides / Coumarins and derivatives
(2R)-2-(2-hydroxypropan-2-yl)-5-methoxy-2,3-dihydropyrano[2,3-h][1,4]benzodioxin-8-one 162894136 Click to see CC(C)(C1COC2=C(C=C3C(=C2O1)C=CC(=O)O3)OC)O 292.28 unknown https://doi.org/10.1016/S0031-9422(99)00087-4
2-(2-Hydroxypropan-2-yl)-5-methoxy-2,3-dihydropyrano[2,3-h][1,4]benzodioxin-8-one 15895670 Click to see CC(C)(C1COC2=C(C=C3C(=C2O1)C=CC(=O)O3)OC)O 292.28 unknown https://doi.org/10.1016/S0031-9422(99)00087-4
2H-1-Benzopyran-2-one, 7-[(3,3-dimethyloxiranyl)methoxy]-6-methoxy- 11277378 Click to see CC1(C(O1)COC2=C(C=C3C=CC(=O)OC3=C2)OC)C 276.28 unknown https://doi.org/10.1016/0031-9422(81)85187-4
6-Methoxy-7-(3-methylbut-2-enoxy)chromen-2-one 1764914 Click to see CC(=CCOC1=C(C=C2C=CC(=O)OC2=C1)OC)C 260.28 unknown https://doi.org/10.1016/S0031-9422(98)00020-X
7-(2-Hydroxy-3-methylbut-3-enoxy)-6-methoxychromen-2-one 10636169 Click to see CC(=C)C(COC1=C(C=C2C=CC(=O)OC2=C1)OC)O 276.28 unknown https://doi.org/10.1016/S0031-9422(98)00020-X
7-[(2R)-2-hydroxy-3-methylbut-3-enoxy]-6-methoxychromen-2-one 163044952 Click to see CC(=C)C(COC1=C(C=C2C=CC(=O)OC2=C1)OC)O 276.28 unknown https://doi.org/10.1016/S0031-9422(98)00020-X
7-[(2S)-2-hydroxy-3-methylbut-3-enoxy]-6-methoxychromen-2-one 163044953 Click to see CC(=C)C(COC1=C(C=C2C=CC(=O)OC2=C1)OC)O 276.28 unknown https://doi.org/10.1016/S0031-9422(98)00020-X
7-[[(2R)-3,3-dimethyloxiran-2-yl]methoxy]-6-methoxychromen-2-one 26113470 Click to see CC1(C(O1)COC2=C(C=C3C=CC(=O)OC3=C2)OC)C 276.28 unknown https://doi.org/10.1016/0031-9422(81)85187-4
9-(3-Hydroxy-3-methyl-2-oxo-butoxy)-[1,3]dioxolo[4,5-g]chromen-6-one 76321600 Click to see CC(C)(C(=O)COC1=C2C=CC(=O)OC2=CC3=C1OCO3)O 306.27 unknown https://doi.org/10.1016/S0031-9422(97)00174-X
9-[(2R)-2,3-dihydroxy-3-methylbutoxy]-[1,3]dioxolo[4,5-g]chromen-6-one 162968188 Click to see CC(C)(C(COC1=C2C=CC(=O)OC2=CC3=C1OCO3)O)O 308.28 unknown https://doi.org/10.1016/S0031-9422(97)00174-X
9-[(3-Methylbut-2-en-1-yl)oxy]-2H,6H-[1,3]dioxolo[4,5-g][1]benzopyran-6-one 46226618 Click to see CC(=CCOC1=C2C=CC(=O)OC2=CC3=C1OCO3)C 274.27 unknown https://doi.org/10.1021/NP50113A010
Ayapin 3083597 Click to see C1OC2=C(O1)C=C3C(=C2)C=CC(=O)O3 190.15 unknown https://doi.org/10.1016/S0031-9422(98)00020-X
Sabandinol 179597 Click to see CC(C)(C(COC1=C2C=CC(=O)OC2=CC3=C1OCO3)O)O 308.28 unknown https://doi.org/10.1016/S0031-9422(97)00174-X
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 7-hydroxycoumarins
Scopoletin 5280460 Click to see COC1=C(C=C2C(=C1)C=CC(=O)O2)O 192.17 unknown https://doi.org/10.1016/S0031-9422(98)00020-X
> Phenylpropanoids and polyketides / Flavonoids / Biflavonoids and polyflavonoids
7''-O-Methylsciadopitysin 5490003 Click to see COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C=C3O)OC)C4=C(C=CC(=C4)C5=CC(=O)C6=C(C=C(C=C6O5)OC)O)OC 594.60 unknown via CMAUP database
8-[5-(5,7-Dihydroxy-4-oxochromen-2-yl)-2-hydroxyphenyl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one 21676279 Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)C4=C(C=C(C5=C4OC(=CC5=O)C6=CC(=C(C=C6)O)O)O)O)O 554.50 unknown via CMAUP database
8-[5-[(2S)-5,7-dihydroxy-4-oxo-2,3-dihydrochromen-2-yl]-2-hydroxyphenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one 44420106 Click to see C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC(=C(C=C3)O)C4=C(C=C(C5=C4OC(=CC5=O)C6=CC=C(C=C6)O)O)O 540.50 unknown via CMAUP database
Amentoflavone 5281600 Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4=C(C=CC(=C4)C5=CC(=O)C6=C(C=C(C=C6O5)O)O)O)O 538.50 unknown via CMAUP database
Kayaflavone 9894522 Click to see COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C=C3O)OC)C4=C(C=CC(=C4)C5=CC(=O)C6=C(C=C(C=C6O5)O)O)OC 580.50 unknown via CMAUP database
Sciadopitysin 5281696 Click to see COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4=C(C=CC(=C4)C5=CC(=O)C6=C(C=C(C=C6O5)OC)O)OC 580.50 unknown via CMAUP database
Sotetsuflavone 5494868 Click to see COC1=C(C2=C(C(=C1)O)C(=O)C=C(O2)C3=CC=C(C=C3)O)C4=C(C=CC(=C4)C5=CC(=O)C6=C(C=C(C=C6O5)O)O)O 552.50 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins
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
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 / Flavanones / Flavanonols
(2R,3R)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-7-(3-methylbut-2-enoxy)-2,3-dihydrochromen-4-one 101919845 Click to see CC(=CCOC1=CC(=C2C(=C1)OC(C(C2=O)O)C3=CC(=C(C=C3)O)O)O)C 372.40 unknown https://doi.org/10.1016/0031-9422(81)85187-4
2-(3,4-Dihydroxyphenyl)-3,5-dihydroxy-7-(3-methylbut-2-enoxy)-2,3-dihydrochromen-4-one 163020087 Click to see CC(=CCOC1=CC(=C2C(=C1)OC(C(C2=O)O)C3=CC(=C(C=C3)O)O)O)C 372.40 unknown https://doi.org/10.1016/0031-9422(81)85187-4
3,5-Dihydroxy-2-(4-hydroxyphenyl)-7-(3-methylbut-2-enoxy)-2,3-dihydrochromen-4-one 74193158 Click to see CC(=CCOC1=CC(=C2C(=C1)OC(C(C2=O)O)C3=CC=C(C=C3)O)O)C 356.40 unknown https://doi.org/10.1016/0031-9422(81)85187-4
7-Prenyloxyaromadendrin 23900109 Click to see CC(=CCOC1=CC(=C2C(=C1)OC(C(C2=O)O)C3=CC=C(C=C3)O)O)C 356.40 unknown https://doi.org/10.1016/0031-9422(81)85187-4
Taxifolin 439533 Click to see C1=CC(=C(C=C1C2C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O 304.25 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavones
8-[4-(4-Oxo-5,7-dihydroxy-4H-1-benzopyran-2-yl)phenoxy]-5,7,4'-trihydroxyflavone 11272651 Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)OC4=CC=C(C=C4)C5=CC(=O)C6=C(C=C(C=C6O5)O)O)O 538.50 unknown via CMAUP database
Apigenin 5280443 Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O 270.24 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavones / Flavonols
Quercetin 5280343 Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O 302.23 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one 5320854 Click to see CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O 448.40 unknown via CMAUP database
kaempferol-3-O-alpha-L-rhamnoside 15558501 Click to see CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC=C(C=C4)O)O)O)O 432.40 unknown via CMAUP database
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
7-(alpha-D-Glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one 12304095 Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O 432.40 unknown via CMAUP database
Quercimeritrin 5282160 Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O)O)O 464.40 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 4-O-methylated flavonoids
Cryptomerin A 5316144 Click to see COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C(=C3O)OC4=CC=C(C=C4)C5=CC(=O)C6=C(C=C(C=C6O5)O)O)O 552.50 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 7-O-methylated flavonoids
6-[4-(5,7-Dihydroxy-4-oxochromen-2-yl)phenoxy]-5-hydroxy-7-methoxy-2-(4-methoxyphenyl)chromen-4-one 5316145 Click to see COC1=CC=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)OC)OC4=CC=C(C=C4)C5=CC(=O)C6=C(C=C(C=C6O5)O)O)O 566.50 unknown via CMAUP database
Apigenin 7,4'-dimethyl ether 5281601 Click to see COC1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)OC)O 298.29 unknown via CMAUP database
Ayanin 5280682 Click to see COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)OC)O)OC)O 344.30 unknown https://doi.org/10.1016/S0031-9422(98)00020-X
Kaempferol 3,7,4'-trimethyl ether 5468749 Click to see COC1=CC=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)OC)O)OC 328.30 unknown via CMAUP database
Retusin 5352005 Click to see COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)OC)O)OC)OC 358.30 unknown via CMAUP database

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