> Alkaloids and derivatives / Harmala alkaloids
|
3-(6-Methoxy-9H-beta-carbolin-1-yl)propanoic acid
|
15109284 |
Click to see
COC1=CC2=C(C=C1)NC3=C2C=CN=C3CCC(=O)O
|
270.28 |
unknown |
https://doi.org/10.1007/BF00630321 |
3-(9H-pyrido[3,4-b]indol-1-yl)propanoic acid
|
5375436 |
Click to see
C1=CC=C2C(=C1)C3=C(N2)C(=NC=C3)CCC(=O)O
|
240.26 |
unknown |
https://doi.org/10.1007/BF00630321 https://doi.org/10.1055/S-2006-961427 |
> Alkaloids and derivatives / Indolonaphthyridine alkaloids
|
10-Hydroxycanthin-6-one
|
158929 |
Click to see
C1=CC2=C(C=C1O)C3=C4N2C(=O)C=CC4=NC=C3
|
236.22 |
unknown |
https://doi.org/10.1055/S-2006-961427 https://doi.org/10.1007/BF00629936 https://doi.org/10.1007/BF00630321 |
12-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-3,5(16),6,8,10,12,14-heptaen-2-one
|
15109283 |
Click to see
C1=CC2=C(C=C1OC3C(C(C(C(O3)CO)O)O)O)C4=C5N2C(=O)C=CC5=NC=C4
|
398.40 |
unknown |
https://doi.org/10.1007/BF00630321 |
12-[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-3,5(16),6,8,10,12,14-heptaen-2-one
|
72745191 |
Click to see
C1=CC2=C(C=C1OC3C(C(C(C(O3)CO)O)O)O)C4=C5N2C(=O)C=CC5=NC=C4
|
398.40 |
unknown |
https://doi.org/10.1007/BF00630321 |
6H-Indolo(3,2,1-de)(1,5)naphthyridin-6-one, 10-methoxy-
|
158928 |
Click to see
COC1=CC2=C(C=C1)N3C(=O)C=CC4=NC=CC2=C43
|
250.25 |
unknown |
https://doi.org/10.1007/BF00630321 https://doi.org/10.1007/BF00629936 https://doi.org/10.1055/S-2006-961427 |
Canthin-6-One
|
97176 |
Click to see
C1=CC=C2C(=C1)C3=C4N2C(=O)C=CC4=NC=C3
|
220.23 |
unknown |
https://doi.org/10.1007/BF00630321 https://doi.org/10.1055/S-2006-961427 |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives
|
Syringic acid
|
10742 |
Click to see
COC1=CC(=CC(=C1O)OC)C(=O)O
|
198.17 |
unknown |
https://doi.org/10.1007/BF00601301 https://doi.org/10.1007/BF00597724 |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / M-methoxybenzoic acids and derivatives
|
Vanillic Acid
|
8468 |
Click to see
COC1=C(C=CC(=C1)C(=O)O)O
|
168.15 |
unknown |
https://doi.org/10.1007/BF00601301 https://doi.org/10.1007/BF00597724 |
> Benzenoids / Phenols / Methoxyphenols
|
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/BF00601301 |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
|
alpha-Amyrin
|
73170 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C
|
426.70 |
unknown |
https://doi.org/10.1007/BF00597724 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Bile acids, alcohols and derivatives / Hydroxy bile acids, alcohols and derivatives
|
2,3,14-trihydroxy-10,13-dimethyl-17-(2,3,6-trihydroxy-6-methylheptan-2-yl)-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one
|
271605 |
Click to see
CC12CCC3C(=CC(=O)C4C3(CC(C(C4)O)O)C)C1(CCC2C(C)(C(CCC(C)(C)O)O)O)O
|
480.60 |
unknown |
https://doi.org/10.1007/BF00629816 |
20-Hydroxyecdysone
|
5459840 |
Click to see
CC12CCC3C(=CC(=O)C4C3(CC(C(C4)O)O)C)C1(CCC2C(C)(C(CCC(C)(C)O)O)O)O
|
480.60 |
unknown |
https://doi.org/10.1007/BF00629816 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
|
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/BF00601301 https://doi.org/10.1007/BF00597724 |
24-Ethylcholest-5-en-3beta-ol
|
22012 |
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/BF00601301 https://doi.org/10.1007/BF00597724 |
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/BF00601301 |
beta-Sitosterol 3-O-beta-D-galactopyranoside
|
296119 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C
|
576.80 |
unknown |
https://doi.org/10.1007/BF00601301 |
Sitogluside
|
5742590 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C
|
576.80 |
unknown |
https://doi.org/10.1007/BF00601301 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds
|
alpha-Maltose
|
439341 |
Click to see
C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)O)CO)O)O)O)O
|
342.30 |
unknown |
https://doi.org/10.1007/BF00597724 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides / Hexoses
|
(2R,3R,4S,5S)-2,3,4,5-tetrahydroxyhexanal
|
19233 |
Click to see
CC(C(C(C(C=O)O)O)O)O
|
164.16 |
unknown |
https://doi.org/10.1007/BF00597724 |
(2R,3S,4S,5R)-2,3,4,5,6-pentahydroxyhexanal
|
3037556 |
Click to see
C(C(C(C(C(C=O)O)O)O)O)O
|
180.16 |
unknown |
https://doi.org/10.1007/BF00597724 |
(2S,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanal
|
161658 |
Click to see
C(C(C(C(C(C=O)O)O)O)O)O
|
180.16 |
unknown |
https://doi.org/10.1007/BF00597724 |
D-Galactose
|
6036 |
Click to see
C(C1C(C(C(C(O1)O)O)O)O)O
|
180.16 |
unknown |
https://doi.org/10.1007/BF00597724 |
D-Glucose
|
5793 |
Click to see
C(C1C(C(C(C(O1)O)O)O)O)O
|
180.16 |
unknown |
https://doi.org/10.1007/BF00597724 |
D-Mannose
|
18950 |
Click to see
C(C1C(C(C(C(O1)O)O)O)O)O
|
180.16 |
unknown |
https://doi.org/10.1007/BF00597724 |
D(+)-Glucose
|
107526 |
Click to see
C(C(C(C(C(C=O)O)O)O)O)O
|
180.16 |
unknown |
https://doi.org/10.1007/BF00597724 |
L-Rhamnose
|
25310 |
Click to see
CC1C(C(C(C(O1)O)O)O)O
|
164.16 |
unknown |
https://doi.org/10.1007/BF00597724 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides / Pentoses
|
(2S,3R,4R)-2,3,4,5-tetrahydroxypentanal
|
66308 |
Click to see
C(C(C(C(C=O)O)O)O)O
|
150.13 |
unknown |
https://doi.org/10.1007/BF00597724 |
D-Xylose
|
135191 |
Click to see
C1C(C(C(C(O1)O)O)O)O
|
150.13 |
unknown |
https://doi.org/10.1007/BF00597724 |
DL-Xylose
|
644160 |
Click to see
C(C(C(C(C=O)O)O)O)O
|
150.13 |
unknown |
https://doi.org/10.1007/BF00597724 |
L-Arabinose
|
439195 |
Click to see
C1C(C(C(C(O1)O)O)O)O
|
150.13 |
unknown |
https://doi.org/10.1007/BF00597724 |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives
|
(E)-3-(4-Hydroxy-3-methoxyphenyl)-N-(2-(4-hydroxy-3-methoxyphenyl)ethyl)-2-propenamide
|
134313 |
Click to see
COC1=C(C=CC(=C1)CCNC(=O)C=CC2=CC(=C(C=C2)O)OC)O
|
343.40 |
unknown |
https://doi.org/10.1007/BF00601301 |
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/BF00601301 |
N-trans-feruloylmethoxytyramine
|
5352115 |
Click to see
COC1=C(C=CC(=C1)CCNC(=O)C=CC2=CC(=C(C=C2)O)OC)O
|
343.40 |
unknown |
https://doi.org/10.1007/BF00601301 |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids
|
Ferulic acid
|
445858 |
Click to see
COC1=C(C=CC(=C1)C=CC(=O)O)O
|
194.18 |
unknown |
https://doi.org/10.1007/BF00597724 |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid 3-O-p-coumaroyl glycosides
|
[6-[5,7-Dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl 3-(4-hydroxyphenyl)prop-2-enoate
|
57369598 |
Click to see
C1=CC(=CC=C1C=CC(=O)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O
|
594.50 |
unknown |
https://doi.org/10.1080/14786419.2014.971794 |
Tiliroside
|
5320686 |
Click to see
C1=CC(=CC=C1C=CC(=O)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O
|
594.50 |
unknown |
https://doi.org/10.1080/14786419.2014.971794 |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
|
3-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4S,5R,6S)-3,4-dihydroxy-6-methyl-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-4-one
|
5318649 |
Click to see
CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OCC3C(C(C(C(O3)OC4=C(OC5=CC(=CC(=C5C4=O)O)O)C6=CC(=C(C=C6)O)OC)O)O)O)C)O)O)O
|
770.70 |
unknown |
https://doi.org/10.1007/BF00630669 |
3-[6-[[3,4-Dihydroxy-6-methyl-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-4-one
|
73157769 |
Click to see
CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OCC3C(C(C(C(O3)OC4=C(OC5=CC(=CC(=C5C4=O)O)O)C6=CC(=C(C=C6)O)OC)O)O)O)C)O)O)O
|
770.70 |
unknown |
https://doi.org/10.1007/BF00630669 |
5,7-Dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-((((2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one
|
5320020 |
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)OC)O)O)O)O)O)O)O
|
624.50 |
unknown |
https://doi.org/10.1007/BF00597724 https://doi.org/10.1007/BF00630669 |
Isorhamnetin 3-robinobioside
|
6223069 |
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)OC)O)O)O)O)O)O
|
624.50 |
unknown |
https://doi.org/10.1007/BF00630669 |
Narcissin
|
5481663 |
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)OC)O)O)O)O)O)O
|
624.50 |
unknown |
https://doi.org/10.1007/BF00597724 https://doi.org/10.1007/BF00630669 |