> Alkaloids and derivatives / Aporphines
|
(R)-Roemerine
|
235224 |
Click to see
CN1CCC2=CC3=C(C4=C2C1CC5=CC=CC=C54)OCO3
|
279.30 |
unknown |
https://doi.org/10.1007/S10600-010-9708-0 |
1-Methoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-2-ol
|
12308663 |
Click to see
COC1=C(C=C2CCNC3C2=C1C4=CC=CC=C4C3)O
|
267.32 |
unknown |
https://doi.org/10.1007/S10600-010-9708-0 |
1,2-Methylenedioxynoraporphine
|
3462225 |
Click to see
C1CNC2CC3=CC=CC=C3C4=C2C1=CC5=C4OCO5
|
265.31 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 https://doi.org/10.1007/S10600-010-9708-0 |
3,5-Dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(20),2(6),7,14,16,18-hexaene-11-carbaldehyde
|
23251787 |
Click to see
C1CN(C2CC3=CC=CC=C3C4=C2C1=CC5=C4OCO5)C=O
|
293.30 |
unknown |
https://doi.org/10.1080/14786410802394132 https://doi.org/10.1007/S10600-010-9708-0 https://doi.org/10.1016/J.BMC.2010.05.045 |
7H-Benzo(g)-1,3-benzodioxolo(6,5,4-de)quinoline-7-carboxaldehyde,5,6,7a,8-tetrahydro-, (7aR)-
|
158516 |
Click to see
C1CN(C2CC3=CC=CC=C3C4=C2C1=CC5=C4OCO5)C=O
|
293.30 |
unknown |
https://doi.org/10.1007/S10600-010-9708-0 https://doi.org/10.1080/14786410802394132 https://doi.org/10.1016/J.BMC.2010.05.045 |
Anonaine
|
160597 |
Click to see
C1CNC2CC3=CC=CC=C3C4=C2C1=CC5=C4OCO5
|
265.31 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 https://doi.org/10.1007/S10600-010-9708-0 |
Asimilobine
|
160875 |
Click to see
COC1=C(C=C2CCNC3C2=C1C4=CC=CC=C4C3)O
|
267.32 |
unknown |
https://doi.org/10.1007/S10600-010-9708-0 |
dl-Nornuciferine
|
41169 |
Click to see
COC1=C(C2=C3C(CC4=CC=CC=C42)NCCC3=C1)OC
|
281.30 |
unknown |
https://doi.org/10.1080/14786410802394132 |
Lanuginosine
|
97622 |
Click to see
COC1=CC2=C(C=C1)C3=C4C(=CC5=C3OCO5)C=CN=C4C2=O
|
305.30 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 https://doi.org/10.1007/S10600-010-9708-0 |
Liriodenine
|
10144 |
Click to see
C1OC2=C(O1)C3=C4C(=C2)C=CN=C4C(=O)C5=CC=CC=C53
|
275.26 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 https://doi.org/10.1007/S10600-010-9708-0 |
Lysicamine
|
122691 |
Click to see
COC1=C(C2=C3C(=C1)C=CN=C3C(=O)C4=CC=CC=C42)OC
|
291.30 |
unknown |
https://doi.org/10.1080/14786410802394132 |
N-acetylanonaine
|
6453733 |
Click to see
CC(=O)N1CCC2=CC3=C(C4=C2C1CC5=CC=CC=C54)OCO3
|
307.30 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 |
N-Acetylbongaridine
|
78411088 |
Click to see
CC(=O)N1CCC2=CC3=C(C4=C2C1CC5=CC=CC=C54)OCO3
|
307.30 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 |
Nornuciferine
|
624491 |
Click to see
COC1=C(C2=C3C(CC4=CC=CC=C42)NCCC3=C1)OC
|
281.30 |
unknown |
https://doi.org/10.1080/14786410802394132 |
Roemerine
|
119204 |
Click to see
CN1CCC2=CC3=C(C4=C2C1CC5=CC=CC=C54)OCO3
|
279.30 |
unknown |
https://doi.org/10.1007/S10600-010-9708-0 |
> Alkaloids and derivatives / Aporphines / Hydroxy-7-aporphines
|
(-)-Oliveroline
|
12444634 |
Click to see
CN1CCC2=CC3=C(C4=C2C1C(C5=CC=CC=C54)O)OCO3
|
295.30 |
unknown |
https://doi.org/10.1080/14786410802394132 |
7-Methyl-6,7,7a,8-tetrahydro-5H-benzo[g][1,3]dioxolo[4',5':4,5]benzo[1,2,3-de]quinolin-8-ol
|
431013 |
Click to see
CN1CCC2=CC3=C(C4=C2C1C(C5=CC=CC=C54)O)OCO3
|
295.30 |
unknown |
https://doi.org/10.1080/14786410802394132 |
Michelalbine
|
10378981 |
Click to see
C1CNC2C(C3=CC=CC=C3C4=C2C1=CC5=C4OCO5)O
|
281.30 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 https://doi.org/10.1007/S10600-010-9708-0 |
Norushinsunine
|
5319820 |
Click to see
C1CNC2C(C3=CC=CC=C3C4=C2C1=CC5=C4OCO5)O
|
281.30 |
unknown |
https://doi.org/10.1007/S10600-010-9708-0 https://doi.org/10.1007/S10600-008-0043-7 |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives
|
4-Hydroxybenzoic acid
|
135 |
Click to see
C1=CC(=CC=C1C(=O)O)O
|
138.12 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives
|
3,4,5-Trimethoxybenzoic Acid
|
8357 |
Click to see
COC1=CC(=CC(=C1OC)OC)C(=O)O
|
212.20 |
unknown |
https://doi.org/10.1007/S10600-010-9708-0 |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / P-methoxybenzoic acids and derivatives
|
3,4-Dimethoxybenzoic acid
|
7121 |
Click to see
COC1=C(C=C(C=C1)C(=O)O)OC
|
182.17 |
unknown |
https://doi.org/10.1007/S10600-010-9708-0 |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / p-Hydroxybenzoic acid esters / p-Hydroxybenzoic acid alkyl esters
|
Methylparaben
|
7456 |
Click to see
COC(=O)C1=CC=C(C=C1)O
|
152.15 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 |
> Benzenoids / Benzene and substituted derivatives / Benzoyl derivatives
|
p-Anisaldehyde
|
31244 |
Click to see
COC1=CC=C(C=C1)C=O
|
136.15 |
unknown |
https://doi.org/10.1007/S10600-010-9708-0 |
> Benzenoids / Benzene and substituted derivatives / Methoxybenzenes / Dimethoxybenzenes
|
Methyl isoeugenol
|
7128 |
Click to see
CC=CC1=CC(=C(C=C1)OC)OC
|
178.23 |
unknown |
https://doi.org/10.1007/S10600-010-9708-0 |
Methylisoeugenol
|
637776 |
Click to see
CC=CC1=CC(=C(C=C1)OC)OC
|
178.23 |
unknown |
https://doi.org/10.1007/S10600-010-9708-0 |
Veratraldehyde
|
8419 |
Click to see
COC1=C(C=C(C=C1)C=O)OC
|
166.17 |
unknown |
https://doi.org/10.1007/S10600-010-9708-0 |
> Benzenoids / Phenols / Methoxyphenols
|
Eugenol
|
3314 |
Click to see
COC1=C(C=CC(=C1)CC=C)O
|
164.20 |
unknown |
https://doi.org/10.1007/S10600-010-9708-0 |
N-Trans-feruloyltramine
|
5280537 |
Click to see
COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CC=C(C=C2)O)O
|
313.30 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 https://doi.org/10.1007/S10600-010-9708-0 |
> Lignans, neolignans and related compounds / Furanoid lignans
|
(3R,3aS,6S,6aS)-3,6-bis(3,4,5-trimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan
|
51407985 |
Click to see
COC1=CC(=CC(=C1OC)OC)C2C3COC(C3CO2)C4=CC(=C(C(=C4)OC)OC)OC
|
446.50 |
unknown |
https://doi.org/10.1080/14786410802394132 |
1,4-Bis(3,4,5-trimethoxyphenyl)tetrahydro-1H,3H-furo[3,4-c]furan
|
99091 |
Click to see
COC1=CC(=CC(=C1OC)OC)C2C3COC(C3CO2)C4=CC(=C(C(=C4)OC)OC)OC
|
446.50 |
unknown |
https://doi.org/10.1080/14786410802394132 |
Syringaresinol
|
100067 |
Click to see
COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC(=C(C(=C4)OC)O)OC
|
418.40 |
unknown |
https://doi.org/10.1007/S10600-010-9708-0 https://doi.org/10.1007/S10600-008-0043-7 |
Syringaresinol, (+)-
|
443023 |
Click to see
COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC(=C(C(=C4)OC)O)OC
|
418.40 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 https://doi.org/10.1007/S10600-010-9708-0 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids
|
Palmitic Acid
|
985 |
Click to see
CCCCCCCCCCCCCCCC(=O)O
|
256.42 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 |
Stearic Acid
|
5281 |
Click to see
CCCCCCCCCCCCCCCCCC(=O)O
|
284.50 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 |
> Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives
|
9,12-Octadecadienoic Acid
|
3931 |
Click to see
CCCCCC=CCC=CCCCCCCCC(=O)O
|
280.40 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 |
Linoleic Acid
|
5280450 |
Click to see
CCCCCC=CCC=CCCCCCCCC(=O)O
|
280.40 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 |
> Lipids and lipid-like molecules / Prenol lipids / Polyprenols / Bactoprenols
|
(2E,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-ol
|
10836209 |
Click to see
CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCO)C)C)C)C)C)C
|
426.70 |
unknown |
https://doi.org/10.1007/S10600-010-9708-0 |
CID 13559233
|
13559233 |
Click to see
CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCO)C)C)C)C)C)C
|
426.70 |
unknown |
https://doi.org/10.1080/14786410802394132 |
Farnesylfarnesol
|
54290761 |
Click to see
CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCO)C)C)C)C)C)C
|
426.70 |
unknown |
https://doi.org/10.1080/14786410802394132 https://doi.org/10.1007/S10600-010-9708-0 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids
|
(+)-4,11-Eudesmadien-3-one
|
273568 |
Click to see
CC1=C2CC(CCC2(CCC1=O)C)C(=C)C
|
218.33 |
unknown |
https://doi.org/10.1080/14786410802394132 |
alpha-Cyperone
|
6452086 |
Click to see
CC1=C2CC(CCC2(CCC1=O)C)C(=C)C
|
218.33 |
unknown |
https://doi.org/10.1080/14786410802394132 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones
|
Epoxyparthenolide
|
154933 |
Click to see
CC12CCC3C(C4C(O4)(CCC1O2)C)OC(=O)C3=C
|
264.32 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 |
Michelenolide
|
442278 |
Click to see
CC12CCC3C(C4C(O4)(CCC1O2)C)OC(=O)C3=C
|
264.32 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Sesquiterpene lactones / Germacranolides and derivatives
|
[(1S,2R,4R,7E,10S,11R)-4,8-dimethyl-12-methylidene-13-oxo-3,14-dioxatricyclo[9.3.0.02,4]tetradec-7-en-10-yl] acetate
|
162995690 |
Click to see
CC1=CCCC2(C(O2)C3C(C(C1)OC(=O)C)C(=C)C(=O)O3)C
|
306.40 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 |
CID 317831
|
317831 |
Click to see
CC1=CCCC2(C(O2)C3C(C(C1)OC(=O)C)C(=C)C(=O)O3)C
|
306.40 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
|
17-(5-ethyl-6-methylhept-3-en-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
|
122544 |
Click to see
CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
412.70 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 |
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/S10600-008-0043-7 https://doi.org/10.1007/S10600-010-9708-0 |
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/S10600-008-0043-7 https://doi.org/10.1007/S10600-010-9708-0 |
Fucostanol
|
6743 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C)C(C)C
|
416.70 |
unknown |
https://doi.org/10.1007/S10600-010-9708-0 |
Stigmastanol
|
241572 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C)C(C)C
|
416.70 |
unknown |
https://doi.org/10.1007/S10600-010-9708-0 |
Stigmasterol
|
5280794 |
Click to see
CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
412.70 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Benzaldehydes / Hydroxybenzaldehydes
|
4-Hydroxybenzaldehyde
|
126 |
Click to see
C1=CC(=CC=C1C=O)O
|
122.12 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 https://doi.org/10.1007/S10600-010-9708-0 |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives
|
N-feruloyltyramine; Moupinamide
|
125213 |
Click to see
COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CC=C(C=C2)O)O
|
313.30 |
unknown |
https://doi.org/10.1007/S10600-008-0043-7 https://doi.org/10.1007/S10600-010-9708-0 |