> Alkaloids and derivatives
|
(5S,7R,9Z,12R,18R)-9-ethylidene-7-(hydroxymethyl)-5-methyl-3,6,11-trioxa-15-azatetracyclo[10.5.1.05,7.015,18]octadec-1(17)-ene-4,10-dione
|
162917910 |
Click to see
CC=C1CC2(C(O2)(C(=O)OCC3=CCN4C3C(CC4)OC1=O)C)CO
|
349.40 |
unknown |
https://doi.org/10.1016/S0031-9422(00)95221-X |
[1,6]Dioxacyclododecino[2,3,4-gh]pyrrolizine-2,7-dione, 3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-methyl-5-methylene-, (3Z,6R,14aR,14bR)-
|
521227 |
Click to see
CC=C1CC(=C)C(C(=O)OCC2=CCN3C2C(CC3)OC1=O)(C)O
|
333.40 |
unknown |
https://doi.org/10.1016/S0031-9422(00)95221-X |
9-Ethylidene-7-(hydroxymethyl)-5-methyl-3,6,11-trioxa-15-azatetracyclo[10.5.1.05,7.015,18]octadec-1(17)-ene-4,10-dione
|
75092738 |
Click to see
CC=C1CC2(C(O2)(C(=O)OCC3=CCN4C3C(CC4)OC1=O)C)CO
|
349.40 |
unknown |
https://doi.org/10.1016/S0031-9422(00)95221-X |
Seneciphylline
|
5281750 |
Click to see
CC=C1CC(=C)C(C(=O)OCC2=CCN3C2C(CC3)OC1=O)(C)O
|
333.40 |
unknown |
https://doi.org/10.1016/S0031-9422(00)95221-X |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acids
|
Benzoic Acid
|
243 |
Click to see
C1=CC=C(C=C1)C(=O)O
|
122.12 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols / Long-chain fatty alcohols
|
(R)-nonacosan-10-ol
|
342803 |
Click to see
CCCCCCCCCCCCCCCCCCCC(CCCCCCCCC)O
|
424.80 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids
|
(2S,4aR,4bS,7R,10aR)-7-ethenyl-1,1,4a,7-tetramethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthren-2-ol
|
22216597 |
Click to see
CC1(C2CCC3=CC(CCC3C2(CCC1O)C)(C)C=C)C
|
288.50 |
unknown |
via CMAUP database |
3-Acetoxy-8(17),13E-labdadien-15-oic acid
|
13858192 |
Click to see
CC(=CC(=O)O)CCC1C(=C)CCC2C1(CCC(C2(C)C)OC(=O)C)C
|
362.50 |
unknown |
via CMAUP database |
3-Oxoanticopalic Acid
|
13858184 |
Click to see
CC(=CC(=O)O)CCC1C(=C)CCC2C1(CCC(=O)C2(C)C)C
|
318.40 |
unknown |
via CMAUP database |
Abietic acid
|
10569 |
Click to see
CC(C)C1=CC2=CCC3C(C2CC1)(CCCC3(C)C(=O)O)C
|
302.50 |
unknown |
via CMAUP database |
Alepterolic acid
|
13858188 |
Click to see
CC(=CC(=O)O)CCC1C(=C)CCC2C1(CCC(C2(C)C)O)C
|
320.50 |
unknown |
via CMAUP database |
Dehydroabietic acid
|
94391 |
Click to see
CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)C(=O)O)C
|
300.40 |
unknown |
via CMAUP database |
Levopimaric acid
|
221062 |
Click to see
CC(C)C1=CCC2C(=C1)CCC3C2(CCCC3(C)C(=O)O)C
|
302.50 |
unknown |
via CMAUP database |
Neoabietic acid
|
221118 |
Click to see
CC(=C1CCC2C(=C1)CCC3C2(CCCC3(C)C(=O)O)C)C
|
302.50 |
unknown |
via CMAUP database |
Sandaracopimaradienediol
|
12313649 |
Click to see
CC1(CCC2C(=C1)CCC3C2(CCC(C3(C)CO)O)C)C=C
|
304.50 |
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 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
|
Linalool, (+)-
|
67179 |
Click to see
CC(=CCCC(C)(C=C)O)C
|
154.25 |
unknown |
via CMAUP database |
Myrcene
|
31253 |
Click to see
CC(=CCCC(=C)C=C)C
|
136.23 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids
|
p-CYMENE
|
7463 |
Click to see
CC1=CC=C(C=C1)C(C)C
|
134.22 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids
|
(-)-beta-Pinene
|
440967 |
Click to see
CC1(C2CCC(=C)C1C2)C
|
136.23 |
unknown |
via CMAUP database |
(+)-alpha-Pinene
|
82227 |
Click to see
CC1=CCC2CC1C2(C)C
|
136.23 |
unknown |
via CMAUP database |
(1R,3R,6R)-3,7,7-trimethylbicyclo[4.1.0]heptane
|
98052623 |
Click to see
CC1CCC2C(C1)C2(C)C
|
138.25 |
unknown |
via CMAUP database |
Bicyclo[2.2.1]heptane, 1,3,3-trimethyl-, (1S,4R)-
|
10877186 |
Click to see
CC1(CC2(CCC1C2)C)C
|
138.25 |
unknown |
via CMAUP database |
Borneol
|
6552009 |
Click to see
CC1(C2CCC1(C(C2)O)C)C
|
154.25 |
unknown |
via CMAUP database |
Bornyl acetate, (-)-
|
93009 |
Click to see
CC(=O)OC1CC2CCC1(C2(C)C)C
|
196.29 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Iridoids and derivatives
|
(1aS,4S,4aR,7S,7aS,7bR)-4,7-dimethyl-1a,2,3,4a,5,6,7a,7b-octahydro-1H-cyclopropa[h]azulene-4,7-diol
|
163021905 |
Click to see
CC1(CCC2CC2C3C1CCC3(C)O)O
|
210.31 |
unknown |
https://doi.org/10.1002/HLCA.201000106 |
4,7-dimethyl-1a,2,3,4a,5,6,7a,7b-octahydro-1H-cyclopropa[h]azulene-4,7-diol
|
163021904 |
Click to see
CC1(CCC2CC2C3C1CCC3(C)O)O
|
210.31 |
unknown |
https://doi.org/10.1002/HLCA.201000106 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids
|
(+)-beta-Phellandrene
|
442484 |
Click to see
CC(C)C1CCC(=C)C=C1
|
136.23 |
unknown |
via CMAUP database |
(+)-Terpinen-4-ol
|
2724161 |
Click to see
CC1=CCC(CC1)(C(C)C)O
|
154.25 |
unknown |
via CMAUP database |
4-Methylidene-1-propan-2-ylcyclohexan-1-ol
|
10197791 |
Click to see
CC(C)C1(CCC(=C)CC1)O
|
154.25 |
unknown |
via CMAUP database |
Limonene, (+)-
|
440917 |
Click to see
CC1=CCC(CC1)C(=C)C
|
136.23 |
unknown |
via CMAUP database |
Terpinolene
|
11463 |
Click to see
CC1=CCC(=C(C)C)CC1
|
136.23 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
|
(1R,4aS,5S,8R,8aR)-5-methyl-2-methylidene-8-propan-2-yl-1,3,4,4a,6,7,8,8a-octahydronaphthalene-1,5-diol
|
102262351 |
Click to see
CC(C)C1CCC(C2C1C(C(=C)CC2)O)(C)O
|
238.37 |
unknown |
https://doi.org/10.1002/HLCA.201000106 |
(1S,3aR,4R,7aS)-1-[(1S)-1-hydroxy-2-methylpropyl]-3a-methyl-7-methylidene-2,3,4,5,6,7a-hexahydro-1H-inden-4-ol
|
46849807 |
Click to see
CC(C)C(C1CCC2(C1C(=C)CCC2O)C)O
|
238.37 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
(4aR,5R,8S,8aR)-5-hydroxy-5-methyl-8-propan-2-yl-4,4a,6,7,8,8a-hexahydro-3H-naphthalene-2-carbaldehyde
|
15548660 |
Click to see
CC(C)C1CCC(C2C1C=C(CC2)C=O)(C)O
|
236.35 |
unknown |
https://doi.org/10.1002/HLCA.201000106 |
(R)-beta-bisabolene
|
68128 |
Click to see
CC1=CCC(CC1)C(=C)CCC=C(C)C
|
204.35 |
unknown |
via CMAUP database |
1-(1-hydroxy-2-methylpropyl)-3a-methyl-7-methylidene-2,3,4,5,6,7a-hexahydro-1H-inden-4-ol
|
73814466 |
Click to see
CC(C)C(C1CCC2(C1C(=C)CCC2O)C)O
|
238.37 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
1-(2-hydroxy-2-methylpropyl)-3a-methyl-7-methylidene-2,3,4,5,6,7a-hexahydro-1H-inden-4-ol
|
76392036 |
Click to see
CC12CCC(C1C(=C)CCC2O)CC(C)(C)O
|
238.37 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
4(15)-Oppositene-1,7-diol
|
11075507 |
Click to see
CC(C)C(C1CCC2(C1C(=C)CCC2O)C)O
|
238.37 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
5-hydroxy-5-methyl-8-propan-2-yl-4,4a,6,7,8,8a-hexahydro-3H-naphthalene-2-carbaldehyde
|
73198139 |
Click to see
CC(C)C1CCC(C2C1C=C(CC2)C=O)(C)O
|
236.35 |
unknown |
https://doi.org/10.1002/HLCA.201000106 |
5-Methyl-2-methylidene-8-propan-2-yl-1,3,4,4a,6,7,8,8a-octahydronaphthalene-1,5-diol
|
85288293 |
Click to see
CC(C)C1CCC(C2C1C(C(=C)CC2)O)(C)O
|
238.37 |
unknown |
https://doi.org/10.1002/HLCA.201000106 |
7-Acetyl-2-hydroxy-2-methyl-5-isopropylbicyclo[4.3.0]nonane
|
539857 |
Click to see
CC(C)C1CCC(C2C1C(CC2)C(=O)C)(C)O
|
238.37 |
unknown |
https://doi.org/10.1002/HLCA.201000106 |
Bisabolol
|
1549992 |
Click to see
CC1=CCC(CC1)C(C)(CCC=C(C)C)O
|
222.37 |
unknown |
via CMAUP database |
delta-Cadinol
|
3084311 |
Click to see
CC1=CC2C(CCC(C2CC1)(C)O)C(C)C
|
222.37 |
unknown |
via CMAUP database |
Oplopanone
|
10466745 |
Click to see
CC(C)C1CCC(C2C1C(CC2)C(=O)C)(C)O
|
238.37 |
unknown |
https://doi.org/10.1002/HLCA.201000106 |
Oppsit-4(15)-Ene-1Beta,11-Diol
|
56672124 |
Click to see
CC12CCC(C1C(=C)CCC2O)CC(C)(C)O
|
238.37 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids
|
(1R,4aR,6R,8aS)-8a-methyl-4-methylidene-6-propan-2-yl-2,3,5,6,7,8-hexahydro-1H-naphthalene-1,4a-diol
|
636618 |
Click to see
CC(C)C1CCC2(C(CCC(=C)C2(C1)O)O)C
|
238.37 |
unknown |
https://doi.org/10.1002/HLCA.201000106 |
(4S,4aS,7S)-4-hydroxy-4a-methyl-7-prop-1-en-2-yl-3,4,5,6,7,8-hexahydro-2H-naphthalene-1-carbaldehyde
|
102262348 |
Click to see
CC(=C)C1CCC2(C(CCC(=C2C1)C=O)O)C
|
234.33 |
unknown |
https://doi.org/10.1002/HLCA.201000106 |
4-hydroxy-4a-methyl-7-prop-1-en-2-yl-3,4,5,6,7,8-hexahydro-2H-naphthalene-1-carbaldehyde
|
162923869 |
Click to see
CC(=C)C1CCC2(C(CCC(=C2C1)C=O)O)C
|
234.33 |
unknown |
https://doi.org/10.1002/HLCA.201000106 |
4(15)-Eudesmene-1beta,7alpha-diol
|
11470456 |
Click to see
CC(C)C1(CCC2(C(CCC(=C)C2C1)O)C)O
|
238.37 |
unknown |
https://doi.org/10.1002/HLCA.201000106 |
8a-methyl-4-methylidene-6-propan-2-yl-2,3,4a,5,7,8-hexahydro-1H-naphthalene-1,6-diol
|
72824221 |
Click to see
CC(C)C1(CCC2(C(CCC(=C)C2C1)O)C)O
|
238.37 |
unknown |
https://doi.org/10.1002/HLCA.201000106 |
8a-methyl-4-methylidene-6-propan-2-yl-2,3,5,6,7,8-hexahydro-1H-naphthalene-1,4a-diol
|
20979096 |
Click to see
CC(C)C1CCC2(C(CCC(=C)C2(C1)O)O)C
|
238.37 |
unknown |
https://doi.org/10.1002/HLCA.201000106 |
Platambin
|
613194 |
Click to see
CC(C)C1CCC2(C(CCC(=C)C2C1O)O)C
|
238.37 |
unknown |
https://doi.org/10.1002/HLCA.201000106 |
Voleneol
|
14137570 |
Click to see
CC(C)C1CCC2(C(CCC(=C)C2C1O)O)C
|
238.37 |
unknown |
https://doi.org/10.1002/HLCA.201000106 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Germacrane sesquiterpenoids
|
(3R,3aR,4R,8R,8aS)-8a-methyl-5-methylidene-3-propan-2-yl-1,2,3,3a,4,6,7,8-octahydroazulene-4,8-diol
|
163017367 |
Click to see
CC(C)C1CCC2(C1C(C(=C)CCC2O)O)C
|
238.37 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
(3R,3aR,8S,8aS)-8-hydroxy-8a-methyl-3-propan-2-yl-2,3,3a,6,7,8-hexahydro-1H-azulene-5-carbaldehyde
|
46849806 |
Click to see
CC(C)C1CCC2(C1C=C(CCC2O)C=O)C
|
236.35 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
(3R,3aS,4R,8S,8aS)-8a-methyl-5-methylidene-3-propan-2-yl-1,2,3,3a,4,6,7,8-octahydroazulene-4,8-diol
|
46849805 |
Click to see
CC(C)C1CCC2(C1C(C(=C)CCC2O)O)C
|
238.37 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
8-hydroxy-8a-methyl-3-propan-2-yl-2,3,3a,6,7,8-hexahydro-1H-azulene-5-carbaldehyde
|
14446663 |
Click to see
CC(C)C1CCC2(C1C=C(CCC2O)C=O)C
|
236.35 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
8a-Methyl-5-methylidene-3-propan-2-yl-1,2,3,3a,4,6,7,8-octahydroazulene-4,8-diol
|
75221124 |
Click to see
CC(C)C1CCC2(C1C(C(=C)CCC2O)O)C
|
238.37 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids / Ergosterols and derivatives
|
(3beta,5alpha,8alpha,22e)-Ergosta-6,22-diene-3,5,8-triol
|
15251535 |
Click to see
CC(C)C(C)C=CC(C)C1CCC2C1(CCC3C2(C=CC4(C3(CCC(C4)O)C)O)O)C
|
430.70 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
17-(5,6-dimethylhept-3-en-2-yl)-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3,5,8-triol
|
73190110 |
Click to see
CC(C)C(C)C=CC(C)C1CCC2C1(CCC3C2(C=CC4(C3(CCC(C4)O)C)O)O)C
|
430.70 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Pregnane steroids / Gluco/mineralocorticoids, progestogins and derivatives
|
12b-Hydroxy-pregn-4-en-3,20-dione
|
99575278 |
Click to see
CC(=O)C1CCC2C1(C(CC3C2CCC4=CC(=O)CCC34C)O)C
|
330.50 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
17-Acetyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
|
4920 |
Click to see
CC(=O)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C
|
314.50 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
17-Acetyl-12-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
|
618734 |
Click to see
CC(=O)C1CCC2C1(C(CC3C2CCC4=CC(=O)CCC34C)O)C
|
330.50 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
Progesterone
|
5994 |
Click to see
CC(=O)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C
|
314.50 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
|
(3S,8R,9R,10R,13R,14R,17R)-17-[(2R,5R)-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
|
11870456 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
414.70 |
unknown |
via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives
|
Methyl 2-(1-hydroxy-2,6-dimethoxy-4-oxocyclohexyl)acetate
|
53660791 |
Click to see
COC1CC(=O)CC(C1(CC(=O)OC)O)OC
|
246.26 |
unknown |
https://doi.org/10.3184/030823409X12615855266040 |
methyl 2-[(2R,6R)-1-hydroxy-2,6-dimethoxy-4-oxocyclohexyl]acetate
|
162893188 |
Click to see
COC1CC(=O)CC(C1(CC(=O)OC)O)OC
|
246.26 |
unknown |
https://doi.org/10.3184/030823409X12615855266040 |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Tertiary alcohols
|
Jacaranone
|
73307 |
Click to see
COC(=O)CC1(C=CC(=O)C=C1)O
|
182.17 |
unknown |
https://doi.org/10.3184/030823409X12615855266040 |
Methyl 2-(1-hydroxy-4-oxocyclohexyl)acetate
|
14287058 |
Click to see
COC(=O)CC1(CCC(=O)CC1)O
|
186.20 |
unknown |
https://doi.org/10.3184/030823409X12615855266040 |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones / Cyclohexenones
|
Methyl 2-(1-hydroxy-6-methoxy-4-oxocyclohex-2-en-1-yl)acetate
|
163062007 |
Click to see
COC1CC(=O)C=CC1(CC(=O)OC)O
|
214.21 |
unknown |
https://doi.org/10.3184/030823409X12615855266040 |
methyl 2-[(1R,6S)-1-hydroxy-6-methoxy-4-oxocyclohex-2-en-1-yl]acetate
|
163062008 |
Click to see
COC1CC(=O)C=CC1(CC(=O)OC)O
|
214.21 |
unknown |
https://doi.org/10.3184/030823409X12615855266040 |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones
|
6-(2-Methyl-6-oxoheptan-3-yl)bicyclo[3.1.0]hexan-2-one
|
73205688 |
Click to see
CC(C)C(CCC(=O)C)C1C2C1C(=O)CC2
|
222.32 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
Chromolaevanedione
|
25084009 |
Click to see
CC(C)C(CCC(=O)C)C1C2C1C(=O)CC2
|
222.32 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
> Organic oxygen compounds / Organooxygen compounds / Ethers / Acetals / Ketals
|
Methyl 2-(2,2-dimethyl-6-oxo-7,7a-dihydro-1,3-benzodioxol-3a-yl)acetate
|
163033791 |
Click to see
CC1(OC2CC(=O)C=CC2(O1)CC(=O)OC)C
|
240.25 |
unknown |
https://doi.org/10.3184/030823409X12615855266040 |
methyl 2-[(3aS,7aR)-2,2-dimethyl-6-oxo-7,7a-dihydro-1,3-benzodioxol-3a-yl]acetate
|
101122457 |
Click to see
CC1(OC2CC(=O)C=CC2(O1)CC(=O)OC)C
|
240.25 |
unknown |
https://doi.org/10.3184/030823409X12615855266040 |
> Organoheterocyclic compounds / Azaspirodecane derivatives
|
7-Hydroxy-3',6,7,14-tetramethylspiro[2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-4,2'-oxirane]-3,8,17-trione
|
322283 |
Click to see
CC1CC2(C(O2)C)C(=O)OC3CCN(CC=C(C3=O)COC(=O)C1(C)O)C
|
381.40 |
unknown |
https://doi.org/10.1016/S0031-9422(00)95221-X |
> Organoheterocyclic compounds / Benzofurans
|
6-Hydroxy-4,4,7a-trimethyl-5,6,7,7a-tetrahydrobenzofuran-2(4H)-one
|
14334 |
Click to see
CC1(CC(CC2(C1=CC(=O)O2)C)O)C
|
196.24 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
Loliolide
|
100332 |
Click to see
CC1(CC(CC2(C1=CC(=O)O2)C)O)C
|
196.24 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
> Organoheterocyclic compounds / Oxepanes
|
(E)-4-[(1S,4S,6R)-4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl]but-3-en-2-one
|
14605580 |
Click to see
CC(=O)C=CC12C(CC(CC1(O2)C)O)(C)C
|
224.30 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
4-(4-Hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-3-buten-2-one
|
181574 |
Click to see
CC(=O)C=CC12C(CC(CC1(O2)C)O)(C)C
|
224.30 |
unknown |
https://doi.org/10.1248/CPB.58.991 |
Methyl 2-(2-hydroxy-3-methoxy-5-oxo-7-oxabicyclo[4.1.0]heptan-2-yl)acetate
|
163038601 |
Click to see
COC1CC(=O)C2C(C1(CC(=O)OC)O)O2
|
230.21 |
unknown |
https://doi.org/10.3184/030823409X12615855266040 |
methyl 2-[(1R,2R,3R,6S)-2-hydroxy-3-methoxy-5-oxo-7-oxabicyclo[4.1.0]heptan-2-yl]acetate
|
163038602 |
Click to see
COC1CC(=O)C2C(C1(CC(=O)OC)O)O2
|
230.21 |
unknown |
https://doi.org/10.3184/030823409X12615855266040 |
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Flavanones
|
Pinocembrin
|
68071 |
Click to see
C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=CC=C3
|
256.25 |
unknown |
via CMAUP database |
Strobopinin
|
442520 |
Click to see
CC1=C(C2=C(C=C1O)OC(CC2=O)C3=CC=CC=C3)O
|
270.28 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Macrolides and analogues
|
4-Ethylidene-7-hydroxy-6,7-dimethyl-2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadec-11-ene-3,8-dione
|
254855 |
Click to see
CC=C1CC(C(C(=O)OCC2=CCN3C2C(CC3)OC1=O)(C)O)C
|
335.40 |
unknown |
https://doi.org/10.1016/S0031-9422(00)95221-X |
Eruciflorine
|
14825842 |
Click to see
CC1CC(=CCO)C(=O)OC2CCN3C2C(=CC3)COC(=O)C1(C)O
|
351.40 |
unknown |
https://doi.org/10.1016/S0031-9422(00)95221-X |
Integerrimine
|
5281733 |
Click to see
CC=C1CC(C(C(=O)OCC2=CCN3C2C(CC3)OC1=O)(C)O)C
|
335.40 |
unknown |
https://doi.org/10.1016/S0031-9422(00)95221-X |
> Phenylpropanoids and polyketides / Stilbenes
|
3-Methoxy-5-(2-phenylethenyl)phenol
|
182229 |
Click to see
COC1=CC(=CC(=C1)O)C=CC2=CC=CC=C2
|
226.27 |
unknown |
via CMAUP database |
3,5-Dimethoxystilbene
|
5316874 |
Click to see
COC1=CC(=CC(=C1)C=CC2=CC=CC=C2)OC
|
240.30 |
unknown |
via CMAUP database |