> 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/10.1080/14786419.2010.523827 https://doi.org/10.1002/CHIN.199746233 |
> Benzenoids / Phenols / Methoxyphenols
|
(2S,3R,5aR,7R,8S,9S,9aR)-2-(4-hydroxy-3-methoxyphenyl)-7-(hydroxymethyl)-2,3,4,5a,7,8,9,9a-octahydropyrano[2,3-b][1,4]dioxepine-3,8,9-triol
|
163104744 |
Click to see
COC1=C(C=CC(=C1)C2C(COC3C(O2)C(C(C(O3)CO)O)O)O)O
|
358.34 |
unknown |
https://doi.org/10.1016/S0031-9422(98)00697-9 |
Guaiacylglycerol
|
14579 |
Click to see
COC1=C(C=CC(=C1)C(C(CO)O)O)O
|
214.21 |
unknown |
https://doi.org/10.1016/S0031-9422(97)00197-0 |
Junipediol A
|
86072622 |
Click to see
COC1=C(C=CC(=C1)C(CO)CO)O
|
198.22 |
unknown |
https://doi.org/10.1016/S0031-9422(96)00684-X |
threo-Guaiacylglycerol
|
11063784 |
Click to see
COC1=C(C=CC(=C1)C(C(CO)O)O)O
|
214.21 |
unknown |
https://doi.org/10.1016/S0031-9422(97)00197-0 |
> Lignans, neolignans and related compounds / Furanoid lignans / Tetrahydrofuran lignans / 9,9-epoxylignans / Dibenzylbutyrolactone lignans
|
(3Z)-3-[(3,4-dihydroxy-5-methoxyphenyl)methylidene]-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one
|
101974136 |
Click to see
COC1=CC(=CC(=C1O)O)C=C2C(COC2=O)CC3=CC(=C(C=C3)O)OC
|
372.40 |
unknown |
https://doi.org/10.1002/CHIN.199746233 |
3-[[3-Methoxy-4,5-bis(trimethylsilyloxy)phenyl]methyl]-4-[(3-methoxy-4-trimethylsilyloxyphenyl)methyl]oxolan-2-one
|
122211995 |
Click to see
COC1=C(C=CC(=C1)CC2COC(=O)C2CC3=CC(=C(C(=C3)O[Si](C)(C)C)O[Si](C)(C)C)OC)O[Si](C)(C)C
|
590.90 |
unknown |
https://doi.org/10.1002/CHIN.199746233 |
Matairesinol
|
119205 |
Click to see
COC1=C(C=CC(=C1)CC2COC(=O)C2CC3=CC(=C(C=C3)O)OC)O
|
358.40 |
unknown |
https://doi.org/10.1002/CHIN.199746233 |
> Lignans, neolignans and related compounds / Lignan lactones
|
beta-Peltatin
|
92122 |
Click to see
COC1=CC(=CC(=C1OC)OC)C2C3C(CC4=C(C5=C(C=C24)OCO5)O)COC3=O
|
414.40 |
unknown |
https://doi.org/10.1021/NP50010A010 |
Deoxypodophyllotoxin
|
345501 |
Click to see
COC1=CC(=CC(=C1OC)OC)C2C3C(CC4=CC5=C(C=C24)OCO5)COC3=O
|
398.40 |
unknown |
https://doi.org/10.1021/NP50010A010 https://doi.org/10.3109/13880209.2014.943246 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids
|
9-Hexadecenoic acid
|
5282745 |
Click to see
CCCCCCC=CCCCCCCCC(=O)O
|
254.41 |
unknown |
https://doi.org/10.1080/14786419.2010.523827 |
Arachidic Acid
|
10467 |
Click to see
CCCCCCCCCCCCCCCCCCCC(=O)O
|
312.50 |
unknown |
https://doi.org/10.1080/14786419.2010.523827 |
Juniperonic acid
|
5312543 |
Click to see
CCC=CCC=CCC=CCCCCC=CCCCC(=O)O
|
304.50 |
unknown |
https://doi.org/10.1080/14786419.2010.523827 |
Myristic Acid
|
11005 |
Click to see
CCCCCCCCCCCCCC(=O)O
|
228.37 |
unknown |
https://doi.org/10.1080/14786419.2010.523827 |
Oleic Acid
|
445639 |
Click to see
CCCCCCCCC=CCCCCCCCC(=O)O
|
282.50 |
unknown |
https://doi.org/10.1080/14786419.2010.523827 |
Sciadonic acid
|
445084 |
Click to see
CCCCCC=CCC=CCCCCC=CCCCC(=O)O
|
306.50 |
unknown |
https://doi.org/10.1080/14786419.2010.523827 |
Stearic Acid
|
5281 |
Click to see
CCCCCCCCCCCCCCCCCC(=O)O
|
284.50 |
unknown |
https://doi.org/10.1080/14786419.2010.523827 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acyl glycosides / Fatty acyl glycosides of mono- and disaccharides
|
(2R,3R,4S,5R,6R)-2-[[(2R,3S,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-[(E)-3-phenylprop-2-enoxy]oxane-3,4,5-triol
|
154497373 |
Click to see
C1=CC=C(C=C1)C=CCOC2C(C(C(C(O2)COC3C(C(C(O3)CO)O)O)O)O)O
|
428.40 |
unknown |
https://doi.org/10.1016/S0031-9422(98)00697-9 |
(4R)-3,5,5-trimethyl-4-[(E,3R)-3-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybut-1-enyl]cyclohex-2-en-1-one
|
163014445 |
Click to see
CC1=CC(=O)CC(C1C=CC(C)OC2C(C(C(C(O2)CO)O)O)O)(C)C
|
370.40 |
unknown |
https://doi.org/10.1016/S0031-9422(98)00697-9 |
2-(Hydroxymethyl)-6-[3-(3,4,5-trimethoxyphenyl)prop-2-enoxy]oxane-3,4,5-triol
|
162902707 |
Click to see
COC1=CC(=CC(=C1OC)OC)C=CCOC2C(C(C(C(O2)CO)O)O)O
|
386.40 |
unknown |
https://doi.org/10.1055/S-2006-957817 |
4-hydroxy-3,5,5-trimethyl-4-[(E,3R)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybut-1-enyl]cyclohex-2-en-1-one
|
6325925 |
Click to see
CC1=CC(=O)CC(C1(C=CC(C)OC2C(C(C(C(O2)CO)O)O)O)O)(C)C
|
386.40 |
unknown |
https://doi.org/10.1016/S0031-9422(98)00697-9 |
4-Hydroxy-3,5,5-trimethyl-4-[3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybut-1-enyl]cyclohex-2-en-1-one
|
73815023 |
Click to see
CC1=CC(=O)CC(C1(C=CC(C)OC2C(C(C(C(O2)CO)O)O)O)O)(C)C
|
386.40 |
unknown |
https://doi.org/10.1016/S0031-9422(98)00697-9 |
Juniperoside
|
15690607 |
Click to see
COC1=CC(=CC(=C1OC)OC)C=CCOC2C(C(C(C(O2)CO)O)O)O
|
386.40 |
unknown |
https://doi.org/10.1055/S-2006-957817 https://doi.org/10.1016/S0031-9422(98)00697-9 |
Rosarin
|
10320370 |
Click to see
C1=CC=C(C=C1)C=CCOC2C(C(C(C(O2)COC3C(C(C(O3)CO)O)O)O)O)O
|
428.40 |
unknown |
https://doi.org/10.1055/S-2006-957817 |
Roseoside
|
9930064 |
Click to see
CC1=CC(=O)CC(C1(C=CC(C)OC2C(C(C(C(O2)CO)O)O)O)O)(C)C
|
386.40 |
unknown |
https://doi.org/10.1016/S0031-9422(98)00697-9 |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids
|
(1R,4aR,4bR,6R,7R,9R,10aR)-7-ethenyl-6,9-dihydroxy-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid
|
162877089 |
Click to see
CC12CCCC(C1CC(C3=CC(C(CC23)O)(C)C=C)O)(C)C(=O)O
|
334.40 |
unknown |
https://doi.org/10.1016/J.PHYTOCHEM.2004.07.021 |
(1R,4aR,4bS,7R,10S,10aR)-7-ethenyl-10-hydroxy-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid
|
101289527 |
Click to see
CC1(CCC2C(=C1)CC(C3C2(CCCC3(C)C(=O)O)C)O)C=C
|
318.40 |
unknown |
https://doi.org/10.1016/S0040-4039(00)89573-8 |
(1R,4aR,5S,8aR)-1,4a-dimethyl-6-methylidene-5-[(2Z)-3-methylpenta-2,4-dienyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
|
124511647 |
Click to see
CC(=CCC1C(=C)CCC2C1(CCCC2(C)C(=O)O)C)C=C
|
302.50 |
unknown |
https://doi.org/10.1016/J.PHYTOCHEM.2004.07.021 |
(1S,4aR,4bR,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid
|
6973653 |
Click to see
CC(C)C1=CC2=CCC3C(C2CC1)(CCCC3(C)C(=O)O)C
|
302.50 |
unknown |
https://doi.org/10.1016/J.PHYTOCHEM.2004.07.021 |
(1S,4aR,4bS,10aS)-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carbaldehyde
|
162982684 |
Click to see
CC(C)C1=CC2=CCC3C(CCCC3(C2CC1)C)(C)C=O
|
286.50 |
unknown |
https://doi.org/10.1016/0031-9422(71)85039-2 |
(1S,4aR,5R,8aR)-5-[(2R,3S)-2-hydroxy-3-methylpentyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
|
162926856 |
Click to see
CCC(C)C(CC1C(=C)CCC2C1(CCCC2(C)C(=O)O)C)O
|
322.50 |
unknown |
https://doi.org/10.1016/S0040-4039(00)89573-8 |
(1S,4aR,5R,8aR)-5-[(2S,3S)-2-hydroxy-3-methylpentyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
|
163189516 |
Click to see
CCC(C)C(CC1C(=C)CCC2C1(CCCC2(C)C(=O)O)C)O
|
322.50 |
unknown |
https://doi.org/10.1016/S0040-4039(00)89573-8 |
(1S,4aS,4bR,8aS,10aR)-8a-hydroxy-1,4a-dimethyl-6-oxo-7-propan-2-yl-2,3,4,4b,5,9,10,10a-octahydrophenanthrene-1-carboxylic acid
|
162965245 |
Click to see
CC(C)C1=CC2(CCC3C(C2CC1=O)(CCCC3(C)C(=O)O)C)O
|
334.40 |
unknown |
https://doi.org/10.1016/J.PHYTOCHEM.2004.07.021 |
(1S,4aS,4bR,8aS,10aR)-8a-hydroxy-7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-6-oxo-2,3,4,4b,5,9,10,10a-octahydrophenanthrene-1-carboxylic acid
|
163012280 |
Click to see
CC12CCCC(C1CCC3(C2CC(=O)C(=C3)C(C)(C)O)O)(C)C(=O)O
|
350.40 |
unknown |
https://doi.org/10.1016/J.PHYTOCHEM.2004.07.021 |
1,4a-dimethyl-6-methylidene-5-(3-methylpenta-2,4-dienyl)-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
|
72957164 |
Click to see
CC(=CCC1C(=C)CCC2C1(CCCC2(C)C(=O)O)C)C=C
|
302.50 |
unknown |
https://doi.org/10.1016/J.PHYTOCHEM.2004.07.021 |
1,4a-Dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carbaldehyde
|
527027 |
Click to see
CC(C)C1=CC2=CCC3C(CCCC3(C2CC1)C)(C)C=O
|
286.50 |
unknown |
https://doi.org/10.1016/0031-9422(71)85039-2 |
5-(2-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
|
162926853 |
Click to see
CCC(C)C(CC1C(=C)CCC2C1(CCCC2(C)C(=O)O)C)O
|
322.50 |
unknown |
https://doi.org/10.1016/S0040-4039(00)89573-8 |
7-ethenyl-10-hydroxy-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid
|
162846968 |
Click to see
CC1(CCC2C(=C1)CC(C3C2(CCCC3(C)C(=O)O)C)O)C=C
|
318.40 |
unknown |
https://doi.org/10.1016/S0040-4039(00)89573-8 |
7-ethenyl-6,9-dihydroxy-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid
|
162877088 |
Click to see
CC12CCCC(C1CC(C3=CC(C(CC23)O)(C)C=C)O)(C)C(=O)O
|
334.40 |
unknown |
https://doi.org/10.1016/J.PHYTOCHEM.2004.07.021 |
8a-Hydroxy-7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-6-oxo-2,3,4,4b,5,9,10,10a-octahydrophenanthrene-1-carboxylic acid
|
163012279 |
Click to see
CC12CCCC(C1CCC3(C2CC(=O)C(=C3)C(C)(C)O)O)(C)C(=O)O
|
350.40 |
unknown |
https://doi.org/10.1016/J.PHYTOCHEM.2004.07.021 |
8alpha-8-Hydroxy-12-oxo-13-abieten-18-oic acid
|
245310 |
Click to see
CC(C)C1=CC2(CCC3C(C2CC1=O)(CCCC3(C)C(=O)O)C)O
|
334.40 |
unknown |
https://doi.org/10.1016/J.PHYTOCHEM.2004.07.021 |
delta8(14)-Pimaric acid
|
10116 |
Click to see
CC1(CCC2C(=C1)CCC3C2(CCCC3(C)C(=O)O)C)C=C
|
302.50 |
unknown |
https://doi.org/10.1016/S0040-4039(00)89573-8 |
methyl (1R,4aR,4bR,6R,7R,9R)-7-ethenyl-6,9-dihydroxy-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate
|
162986299 |
Click to see
CC12CCCC(C1CC(C3=CC(C(CC23)O)(C)C=C)O)(C)C(=O)OC
|
348.50 |
unknown |
https://doi.org/10.1002/CHIN.200510180 |
methyl (1S,4aR,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate
|
92221224 |
Click to see
CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)C(=O)OC)C
|
314.50 |
unknown |
https://doi.org/10.1016/0031-9422(71)85039-2 |
methyl (1S,4aS,4bR,8aS)-8a-hydroxy-1,4a-dimethyl-6-oxo-7-propan-2-yl-2,3,4,4b,5,9,10,10a-octahydrophenanthrene-1-carboxylate
|
11382475 |
Click to see
CC(C)C1=CC2(CCC3C(C2CC1=O)(CCCC3(C)C(=O)OC)C)O
|
348.50 |
unknown |
https://doi.org/10.1002/CHIN.200510180 |
methyl (1S,4aS,4bR,8aS)-8a-hydroxy-7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-6-oxo-2,3,4,4b,5,9,10,10a-octahydrophenanthrene-1-carboxylate
|
11222281 |
Click to see
CC12CCCC(C1CCC3(C2CC(=O)C(=C3)C(C)(C)O)O)(C)C(=O)OC
|
364.50 |
unknown |
https://doi.org/10.1002/CHIN.200510180 |
methyl (1S,4aS,4bS,10aS)-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylate
|
26079670 |
Click to see
CC(C)C1=CC2=CCC3C(C2CC1)(CCCC3(C)C(=O)OC)C
|
316.50 |
unknown |
https://doi.org/10.1016/0031-9422(71)85039-2 |
methyl (1S,5S,9S,10R,12S)-16-(2-hydroperoxypropan-2-yl)-5,9-dimethyl-13,14-dioxatetracyclo[10.2.2.01,10.04,9]hexadec-15-ene-5-carboxylate
|
163093185 |
Click to see
CC12CCCC(C1CCC34C2CC(C(=C3)C(C)(C)OO)OO4)(C)C(=O)OC
|
380.50 |
unknown |
https://doi.org/10.1002/CHIN.200510180 |
methyl (1S,5S,9S,10R,12S)-16-(2-hydroxypropan-2-yl)-5,9-dimethyl-13,14-dioxatetracyclo[10.2.2.01,10.04,9]hexadec-15-ene-5-carboxylate
|
162975263 |
Click to see
CC12CCCC(C1CCC34C2CC(C(=C3)C(C)(C)O)OO4)(C)C(=O)OC
|
364.50 |
unknown |
https://doi.org/10.1002/CHIN.200510180 |
Methyl abieta-7,13-dien-18-oate
|
516981 |
Click to see
CC(C)C1=CC2=CCC3C(C2CC1)(CCCC3(C)C(=O)OC)C
|
316.50 |
unknown |
https://doi.org/10.1016/0031-9422(71)85039-2 |
Methyl abieta-8,11,13-trien-18-oate
|
247581 |
Click to see
CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)C(=O)OC)C
|
314.50 |
unknown |
https://doi.org/10.1016/0031-9422(71)85039-2 |
Sandaracopimaric Acid
|
221580 |
Click to see
CC1(CCC2C(=C1)CCC3C2(CCCC3(C)C(=O)O)C)C=C
|
302.50 |
unknown |
https://doi.org/10.1016/S0040-4039(00)89573-8 https://doi.org/10.1021/NP50116A012 |
Totarol
|
92783 |
Click to see
CC(C)C1=C(C=CC2=C1CCC3C2(CCCC3(C)C)C)O
|
286.50 |
unknown |
https://doi.org/10.1080/14786419.2010.523827 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
|
Geraniol
|
637566 |
Click to see
CC(=CCCC(=CCO)C)C
|
154.25 |
unknown |
https://doi.org/10.1016/S0021-9673(01)84593-3 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids
|
4-Terpineol, (+/-)-
|
11230 |
Click to see
CC1=CCC(CC1)(C(C)C)O
|
154.25 |
unknown |
https://doi.org/10.1016/S0021-9673(01)84593-3 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
|
(1aS,4aR,8aR)-4a,8,8-trimethyl-1,1a,4,5,6,7-hexahydrocyclopropa[j]naphthalene-2-carboxylic acid
|
162901095 |
Click to see
CC1(CCCC2(C13CC3C(=CC2)C(=O)O)C)C
|
234.33 |
unknown |
https://doi.org/10.3891/ACTA.CHEM.SCAND.14-1995 |
1-Methyl-4-(1,2,2-trimethylcyclopentyl)benzene
|
519346 |
Click to see
CC1=CC=C(C=C1)C2(CCCC2(C)C)C
|
202.33 |
unknown |
https://doi.org/10.3891/ACTA.CHEM.SCAND.14-1995 |
4a,8,8-Trimethyl-1,1a,4,5,6,7-hexahydrocyclopropa[j]naphthalene-2-carboxylic acid
|
12310494 |
Click to see
CC1(CCCC2(C13CC3C(=CC2)C(=O)O)C)C
|
234.33 |
unknown |
https://doi.org/10.3891/ACTA.CHEM.SCAND.14-1995 |
Cuparene
|
86895 |
Click to see
CC1=CC=C(C=C1)C2(CCCC2(C)C)C
|
202.33 |
unknown |
https://doi.org/10.3891/ACTA.CHEM.SCAND.14-1995 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Abscisic acids and derivatives
|
(2E,4E)-5-[(1S,3R,5S,8R)-8-hydroxy-1,5-dimethyl-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-oxabicyclo[3.2.1]octan-8-yl]-3-methylpenta-2,4-dienoic acid
|
162939832 |
Click to see
CC(=CC(=O)O)C=CC1(C2(CC(CC1(OC2)C)OC3C(C(C(C(O3)CO)O)O)O)C)O
|
444.50 |
unknown |
https://doi.org/10.1016/S0031-9422(98)00697-9 |
(2Z,4E)-5-[(3S,8S)-8-hydroxy-1,5-dimethyl-3-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-oxabicyclo[3.2.1]octan-8-yl]-3-methylpenta-2,4-dienoic acid
|
163194341 |
Click to see
CC(=CC(=O)O)C=CC1(C2(CC(CC1(OC2)C)OC3C(C(C(C(O3)CO)O)O)O)C)O
|
444.50 |
unknown |
https://doi.org/10.1016/S0031-9422(98)00697-9 |
5-[8-Hydroxy-1,5-dimethyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-oxabicyclo[3.2.1]octan-8-yl]-3-methylpenta-2,4-dienoic acid
|
73170036 |
Click to see
CC(=CC(=O)O)C=CC1(C2(CC(CC1(OC2)C)OC3C(C(C(C(O3)CO)O)O)O)C)O
|
444.50 |
unknown |
https://doi.org/10.1016/S0031-9422(98)00697-9 |
dihydrophaseic acid 4-O-beta-D-glucoside
|
11988281 |
Click to see
CC(=CC(=O)O)C=CC1(C2(CC(CC1(OC2)C)OC3C(C(C(C(O3)CO)O)O)O)C)O
|
444.50 |
unknown |
https://doi.org/10.1016/S0031-9422(98)00697-9 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Cedrane and isocedrane sesquiterpenoids
|
Cedran-8-ol
|
522667 |
Click to see
CC1CCC2C13CCC(C(C3)C2(C)C)(C)O
|
222.37 |
unknown |
https://doi.org/10.3891/ACTA.CHEM.SCAND.14-1995 |
Cedrol
|
65575 |
Click to see
CC1CCC2C13CCC(C(C3)C2(C)C)(C)O
|
222.37 |
unknown |
https://doi.org/10.3891/ACTA.CHEM.SCAND.14-1995 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides
|
(4R,5R)-4-[(E,3R)-3-hydroxybut-1-enyl]-3,5-dimethyl-5-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]cyclohex-2-en-1-one
|
163010357 |
Click to see
CC1=CC(=O)CC(C1C=CC(C)O)(C)COC2C(C(C(C(O2)CO)O)O)O
|
386.40 |
unknown |
https://doi.org/10.1016/S0031-9422(98)00697-9 |
4-[(E,3R)-3-hydroxybut-1-enyl]-3,5-dimethyl-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]cyclohex-2-en-1-one
|
100966497 |
Click to see
CC1=CC(=O)CC(C1C=CC(C)O)(C)COC2C(C(C(C(O2)CO)O)O)O
|
386.40 |
unknown |
https://doi.org/10.1016/S0031-9422(98)00697-9 |
4-hydroxy-4-[(E,3R)-3-hydroxybut-1-enyl]-3,5-dimethyl-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]cyclohex-2-en-1-one
|
100966498 |
Click to see
CC1=CC(=O)CC(C1(C=CC(C)O)O)(C)COC2C(C(C(C(O2)CO)O)O)O
|
402.40 |
unknown |
https://doi.org/10.1016/S0031-9422(98)00697-9 |
4-hydroxy-4-[(E)-3-hydroxybut-1-enyl]-3,5-dimethyl-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]cyclohex-2-en-1-one
|
11968600 |
Click to see
CC1=CC(=O)CC(C1(C=CC(C)O)O)(C)COC2C(C(C(C(O2)CO)O)O)O
|
402.40 |
unknown |
https://doi.org/10.1016/S0031-9422(98)00697-9 |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Tertiary alcohols
|
1,1,4a,7-Tetramethyl-2,3,4,4a,5,6,7,8-octahydro-1H-benzo[a]cyclohepten-7-ol
|
522326 |
Click to see
CC1(CCCC2(C1=CCC(CC2)(C)O)C)C
|
222.37 |
unknown |
https://doi.org/10.3891/ACTA.CHEM.SCAND.14-1995 |
Widdrol
|
94334 |
Click to see
CC1(CCCC2(C1=CCC(CC2)(C)O)C)C
|
222.37 |
unknown |
https://doi.org/10.3891/ACTA.CHEM.SCAND.14-1995 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds
|
(2R,3R,4S,5S,6R)-2-[(2R)-2-(1,3-benzodioxol-5-yl)-3-hydroxypropoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
38347240 |
Click to see
C1OC2=C(O1)C=C(C=C2)C(CO)COC3C(C(C(C(O3)CO)O)O)O
|
358.34 |
unknown |
https://doi.org/10.1016/S0031-9422(96)00684-X https://doi.org/10.1016/S0031-9422(98)00697-9 |
(2R,3R,4S,5S,6R)-2-[(2R)-3-hydroxy-2-(4-hydroxy-3-methoxyphenyl)propoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
38363186 |
Click to see
COC1=C(C=CC(=C1)C(CO)COC2C(C(C(C(O2)CO)O)O)O)O
|
360.36 |
unknown |
https://doi.org/10.1016/S0031-9422(96)00684-X https://doi.org/10.1016/S0031-9422(98)00697-9 |
2-[2-(1,3-Benzodioxol-5-yl)-3-hydroxypropoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
74208358 |
Click to see
C1OC2=C(O1)C=C(C=C2)C(CO)COC3C(C(C(C(O3)CO)O)O)O
|
358.34 |
unknown |
https://doi.org/10.1016/S0031-9422(96)00684-X |
2-[3-Hydroxy-2-(4-hydroxy-3-methoxyphenyl)propoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
75130902 |
Click to see
COC1=C(C=CC(=C1)C(CO)COC2C(C(C(C(O2)CO)O)O)O)O
|
360.36 |
unknown |
https://doi.org/10.1016/S0031-9422(96)00684-X |
5-methyl-2-[2-[5-methyl-3-oxo-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyfuran-2-yl]propan-2-yl]-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyfuran-3-one
|
101696391 |
Click to see
CC1=C(C(=O)C(O1)C(C)(C)C2C(=O)C(=C(O2)C)OC3C(C(C(C(O3)CO)O)O)O)OC4C(C(C(C(O4)CO)O)O)O
|
592.50 |
unknown |
https://doi.org/10.1016/0040-4039(96)00453-4 |
5-methyl-2-propan-2-ylidene-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyfuran-3-one
|
10829177 |
Click to see
CC1=C(C(=O)C(=C(C)C)O1)OC2C(C(C(C(O2)CO)O)O)O
|
316.30 |
unknown |
https://doi.org/10.1016/0031-9422(95)00730-X |
5-Methyl-2-propan-2-ylidene-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyfuran-3-one
|
85281894 |
Click to see
CC1=C(C(=O)C(=C(C)C)O1)OC2C(C(C(C(O2)CO)O)O)O
|
316.30 |
unknown |
https://doi.org/10.1016/0031-9422(95)00730-X |
5-methyl-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyfuran-3-one
|
92023871 |
Click to see
CC1=C(C(=O)CO1)OC2C(C(C(C(O2)CO)O)O)O
|
276.24 |
unknown |
https://doi.org/10.1016/0031-9422(95)00730-X |
5-Methyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyfuran-3-one
|
162880693 |
Click to see
CC1=C(C(=O)CO1)OC2C(C(C(C(O2)CO)O)O)O
|
276.24 |
unknown |
https://doi.org/10.1016/0031-9422(95)00730-X |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides
|
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[2-methoxy-4-(1,2,3-trihydroxypropyl)phenoxy]oxane-3,4,5-triol
|
101713170 |
Click to see
COC1=C(C=CC(=C1)C(C(CO)O)O)OC2C(C(C(C(O2)CO)O)O)O
|
376.36 |
unknown |
https://doi.org/10.1016/S0031-9422(97)00197-0 |
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[2-methoxy-4-[(1R,2R)-1,2,3-trihydroxypropyl]phenoxy]oxane-3,4,5-triol
|
10970833 |
Click to see
COC1=C(C=CC(=C1)C(C(CO)O)O)OC2C(C(C(C(O2)CO)O)O)O
|
376.36 |
unknown |
https://doi.org/10.1016/S0031-9422(97)00197-0 |
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[2-methoxy-4-[(1S,2R)-1,2,3-trihydroxypropyl]phenoxy]oxane-3,4,5-triol
|
163043963 |
Click to see
COC1=C(C=CC(=C1)C(C(CO)O)O)OC2C(C(C(C(O2)CO)O)O)O
|
376.36 |
unknown |
https://doi.org/10.1016/S0031-9422(98)00697-9 |
2-(Hydroxymethyl)-6-[2-methoxy-4-(1,2,3-trihydroxypropyl)phenoxy]oxane-3,4,5-triol
|
73804542 |
Click to see
COC1=C(C=CC(=C1)C(C(CO)O)O)OC2C(C(C(C(O2)CO)O)O)O
|
376.36 |
unknown |
https://doi.org/10.1016/S0031-9422(97)00197-0 |
> Organoheterocyclic compounds / Oxepanes
|
methyl (1R,5S,9S,10R,12S,14S,15R)-14-(2-hydroperoxypropan-2-yl)-5,9-dimethyl-13,16-dioxapentacyclo[8.6.0.01,15.04,9.012,14]hexadecane-5-carboxylate
|
162834997 |
Click to see
CC12CCCC(C1CCC34C2CC5C(C3O4)(O5)C(C)(C)OO)(C)C(=O)OC
|
380.50 |
unknown |
https://doi.org/10.1002/CHIN.200510180 |
> Organoheterocyclic compounds / Pyranodioxins
|
(2S,3S,4aS,6R,7S,8S,8aR)-2-(4-hydroxy-3-methoxyphenyl)-3,6-bis(hydroxymethyl)-3,4a,6,7,8,8a-hexahydro-2H-pyrano[2,3-b][1,4]dioxine-7,8-diol
|
101730738 |
Click to see
COC1=C(C=CC(=C1)C2C(OC3C(O2)C(C(C(O3)CO)O)O)CO)O
|
358.34 |
unknown |
https://doi.org/10.1016/S0031-9422(97)00197-0 |
(4aS,6R,7S,8S,8aR)-2-(4-hydroxy-3-methoxyphenyl)-3,6-bis(hydroxymethyl)-3,4a,6,7,8,8a-hexahydro-2H-pyrano[2,3-b][1,4]dioxine-7,8-diol
|
101713169 |
Click to see
COC1=C(C=CC(=C1)C2C(OC3C(O2)C(C(C(O3)CO)O)O)CO)O
|
358.34 |
unknown |
https://doi.org/10.1016/S0031-9422(97)00197-0 |
2-(4-hydroxy-3-methoxyphenyl)-3,6-bis(hydroxymethyl)-3,4a,6,7,8,8a-hexahydro-2H-pyrano[2,3-b][1,4]dioxine-7,8-diol
|
162884807 |
Click to see
COC1=C(C=CC(=C1)C2C(OC3C(O2)C(C(C(O3)CO)O)O)CO)O
|
358.34 |
unknown |
https://doi.org/10.1016/S0031-9422(97)00197-0 |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids
|
p-Coumaric acid
|
637542 |
Click to see
C1=CC(=CC=C1C=CC(=O)O)O
|
164.16 |
unknown |
https://doi.org/10.1002/CHIN.199746233 |
> Phenylpropanoids and polyketides / Coumarins and derivatives / Coumarin glycosides
|
7-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one
|
22816386 |
Click to see
C1=CC(=CC2=C1C=CC(=O)O2)OC3C(C(C(C(O3)CO)O)O)O
|
324.28 |
unknown |
https://doi.org/10.1016/S0031-9422(98)00697-9 |
7-[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one
|
320361 |
Click to see
C1=CC(=CC2=C1C=CC(=O)O2)OC3C(C(C(C(O3)CO)O)O)O
|
324.28 |
unknown |
https://doi.org/10.1055/S-2006-957817 |
Skimmin
|
99693 |
Click to see
C1=CC(=CC2=C1C=CC(=O)O2)OC3C(C(C(C(O3)CO)O)O)O
|
324.28 |
unknown |
https://doi.org/10.1055/S-2006-957817 |
> Phenylpropanoids and polyketides / Flavonoids / Biflavonoids and polyflavonoids
|
Cupressuflavone
|
5281609 |
Click to see
C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4=C(C=C(C5=C4OC(=CC5=O)C6=CC=C(C=C6)O)O)O)O
|
538.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)85693-9 |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
|
Myricitrin
|
5281673 |
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)O
|
464.40 |
unknown |
https://doi.org/10.1016/S0031-9422(00)85693-9 |
Quercitrin
|
5280459 |
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 |
https://doi.org/10.1016/S0031-9422(00)85693-9 |
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 6-O-methylated flavonoids
|
Jaceidin
|
5464461 |
Click to see
COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(O2)C=C(C(=C3O)OC)O)OC)O
|
360.30 |
unknown |
https://doi.org/10.1016/S0031-9422(00)85693-9 |
> Phenylpropanoids and polyketides / Tannins
|
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 |
https://doi.org/10.1002/CHIN.199746233 |