> 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/10.1007/S10600-005-0115-X |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eremophilane, 8,9-secoeremophilane and furoeremophilane sesquiterpenoids
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(4S)-4-hydroperoxy-3,4,5-trimethylbenzo[f][1]benzofuran-9-one
|
162952223 |
Click to see
CC1=C2C(=CC=C1)C(=O)C3=C(C2(C)OO)C(=CO3)C
|
258.27 |
unknown |
https://doi.org/10.1246/CL.1976.73 |
(4S)-4-hydroxy-6-methoxy-3,4,5-trimethylbenzo[f][1]benzofuran-9-one
|
162890689 |
Click to see
CC1=COC2=C1C(C3=C(C2=O)C=CC(=C3C)OC)(C)O
|
272.29 |
unknown |
https://doi.org/10.1246/CL.1976.73 |
3-Isopropylidene-4aalpha,5alpha-dimethyl-1,2,3,4,4a,5,6,7,8,8aalpha-decahydronaphthalene-2-one
|
11368014 |
Click to see
CC1CCCC2C1(CC(=C(C)C)C(=O)C2)C
|
220.35 |
unknown |
https://doi.org/10.1016/0031-9422(73)80509-6 |
4-Hydroperoxy-3,4,5-trimethylbenzo[f][1]benzofuran-9-one
|
85859293 |
Click to see
CC1=C2C(=CC=C1)C(=O)C3=C(C2(C)OO)C(=CO3)C
|
258.27 |
unknown |
https://doi.org/10.1246/CL.1976.73 |
4-Hydroxy-6-methoxy-3,4,5-trimethylbenzo[f][1]benzofuran-9-one
|
162890688 |
Click to see
CC1=COC2=C1C(C3=C(C2=O)C=CC(=C3C)OC)(C)O
|
272.29 |
unknown |
https://doi.org/10.1246/CL.1976.73 |
4a,5-Dimethyl-3-propan-2-ylidene-4,5,6,7,8,8a-hexahydro-1H-naphthalen-2-one
|
12309917 |
Click to see
CC1CCCC2C1(CC(=C(C)C)C(=O)C2)C
|
220.35 |
unknown |
https://doi.org/10.1016/0031-9422(73)80509-6 |
4a,5-dimethyl-3-propan-2-ylidene-5,6,7,8-tetrahydro-4H-naphthalen-2-one
|
612721 |
Click to see
CC1CCCC2=CC(=O)C(=C(C)C)CC12C
|
218.33 |
unknown |
https://doi.org/10.1016/0031-9422(73)80509-6 |
9-Methoxy-3,4,5-trimethyl-5,6-dihydrobenzo[f][1]benzofuran
|
14431897 |
Click to see
CC1CC=CC2=C1C(=C3C(=COC3=C2OC)C)C
|
242.31 |
unknown |
https://doi.org/10.1246/CL.1976.73 |
Cacalohastine
|
3084997 |
Click to see
CC1CC=CC2=C1C(=C3C(=COC3=C2OC)C)C
|
242.31 |
unknown |
https://doi.org/10.1246/CL.1976.73 https://doi.org/10.1016/0031-9422(73)80509-6 |
Dehydrofukinone
|
177072 |
Click to see
CC1CCCC2=CC(=O)C(=C(C)C)CC12C
|
218.33 |
unknown |
https://doi.org/10.1016/0031-9422(73)80509-6 |
Naphtho(2,3-b)furan, 9-methoxy-3,4,5-trimethyl-
|
3084982 |
Click to see
CC1=C2C(=C3C(=COC3=C(C2=CC=C1)OC)C)C
|
240.30 |
unknown |
https://doi.org/10.1016/0031-9422(73)80509-6 https://doi.org/10.1246/CL.1976.73 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones
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(3S,5S)-9-hydroxy-3,4,5-trimethyl-5,6,7,8-tetrahydro-3H-benzo[f][1]benzofuran-2-one
|
101286248 |
Click to see
CC1CCCC2=C(C3=C(C(C(=O)O3)C)C(=C12)C)O
|
246.30 |
unknown |
https://doi.org/10.1246/CL.1976.73 |
7,7a-dimethyl-4'-methylidenespiro[3,3a,4,5,6,7-hexahydro-1H-indene-2,3'-oxolane]-2'-one
|
325065 |
Click to see
CC1CCCC2C1(CC3(C2)C(=C)COC3=O)C
|
234.33 |
unknown |
https://doi.org/10.1246/CL.1976.73 https://doi.org/10.1016/0031-9422(73)80509-6 |
Bakkenolide A
|
442173 |
Click to see
CC1CCCC2C1(CC3(C2)C(=C)COC3=O)C
|
234.33 |
unknown |
https://doi.org/10.1016/0031-9422(73)80509-6 https://doi.org/10.1246/CL.1976.73 |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
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3-Hydroxyolean-12-en-28-oic acid
|
619166 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C
|
456.70 |
unknown |
https://doi.org/10.1007/S10600-005-0219-3 |
Oleanolic Acid
|
10494 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C
|
456.70 |
unknown |
https://doi.org/10.1007/S10600-005-0219-3 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
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17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
|
86821 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
414.70 |
unknown |
https://doi.org/10.1007/S10600-005-0219-3 |
Beta-Sitosterol
|
222284 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
414.70 |
unknown |
https://doi.org/10.1007/S10600-005-0219-3 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Dicarboxylic acids and derivatives
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Oxalic Acid
|
971 |
Click to see
C(=O)(C(=O)O)O
|
90.03 |
unknown |
https://doi.org/10.1023/B:CONC.0000039145.63701.2F |
> Organic acids and derivatives / Carboxylic acids and derivatives / Tricarboxylic acids and derivatives
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Citric Acid
|
311 |
Click to see
C(C(=O)O)C(CC(=O)O)(C(=O)O)O
|
192.12 |
unknown |
https://doi.org/10.1023/B:CONC.0000039145.63701.2F |
> Organic acids and derivatives / Hydroxy acids and derivatives / Beta hydroxy acids and derivatives
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(2S)-2-Hydroxybutanedioic acid
|
222656 |
Click to see
C(C(C(=O)O)O)C(=O)O
|
134.09 |
unknown |
https://doi.org/10.1023/B:CONC.0000039145.63701.2F |
Malic Acid
|
525 |
Click to see
C(C(C(=O)O)O)C(=O)O
|
134.09 |
unknown |
https://doi.org/10.1023/B:CONC.0000039145.63701.2F |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives
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3-{[3-(3,4-Dihydroxyphenyl)prop-2-enoyl]oxy}-1,4,5-trihydroxycyclohexane-1-carboxylic acid
|
348159 |
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/10.1007/S10600-005-0115-X |
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/10.1007/S10600-005-0115-X |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Sugar acids and derivatives
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DL-Tartaric acid
|
875 |
Click to see
C(C(C(=O)O)O)(C(=O)O)O
|
150.09 |
unknown |
https://doi.org/10.1023/B:CONC.0000039145.63701.2F |
Mesotartaric acid
|
447315 |
Click to see
C(C(C(=O)O)O)(C(=O)O)O
|
150.09 |
unknown |
https://doi.org/10.1023/B:CONC.0000039145.63701.2F |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids
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3,4-Dihydroxy cinnamic acid
|
2518 |
Click to see
C1=CC(=C(C=C1C=CC(=O)O)O)O
|
180.16 |
unknown |
https://doi.org/10.1007/S10600-005-0115-X |
Caffeic Acid
|
689043 |
Click to see
C1=CC(=C(C=C1C=CC(=O)O)O)O
|
180.16 |
unknown |
https://doi.org/10.1007/S10600-005-0115-X |
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 6,7-dihydroxycoumarins
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Esculetin
|
5281416 |
Click to see
C1=CC(=O)OC2=CC(=C(C=C21)O)O
|
178.14 |
unknown |
https://doi.org/10.1007/S10600-005-0219-3 |
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 7-hydroxycoumarins
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Scopoletin
|
5280460 |
Click to see
COC1=C(C=C2C(=C1)C=CC(=O)O2)O
|
192.17 |
unknown |
https://doi.org/10.1007/S10600-005-0219-3 |
Umbelliferone
|
5281426 |
Click to see
C1=CC(=CC2=C1C=CC(=O)O2)O
|
162.14 |
unknown |
https://doi.org/10.1007/S10600-005-0219-3 |
> Phenylpropanoids and polyketides / Macrolides and analogues
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(1S,4Z,7S,17S)-4-ethylidene-7-hydroxy-6,7-dimethyl-2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadec-11-ene-3,8-dione
|
133562009 |
Click to see
CC=C1CC(C(C(=O)OCC2=CCN3C2C(CC3)OC1=O)(C)O)C
|
335.40 |
unknown |
https://doi.org/10.1248/CPB.20.201 |