> Alkaloids and derivatives / Camptothecins
|
(+)-Camptothecin
|
2538 |
Click to see
CCC1(C2=C(COC1=O)C(=O)N3CC4=CC5=CC=CC=C5N=C4C3=C2)O
|
348.40 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
(4S)-4-Ethyl-4-hydroxy-10-methoxy-1H-pyrano[3',4'
|
494163 |
Click to see
CCC1(C2=C(COC1=O)C(=O)N3CC4=CC5=C(C=CC=C5OC)N=C4C3=C2)O
|
378.40 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
10-Methoxycamptothecin
|
97283 |
Click to see
CCC1(C2=C(COC1=O)C(=O)N3CC4=C(C3=C2)N=C5C=CC(=CC5=C4)OC)O
|
378.40 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
9-Methoxycamptothecin
|
123617 |
Click to see
CCC1(C2=C(COC1=O)C(=O)N3CC4=CC5=C(C=CC=C5OC)N=C4C3=C2)O
|
378.40 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
Camptothecin
|
24360 |
Click to see
CCC1(C2=C(COC1=O)C(=O)N3CC4=CC5=CC=CC=C5N=C4C3=C2)O
|
348.40 |
unknown |
https://doi.org/10.1002/CHIN.200612187 https://doi.org/10.1248/CPB.53.1355 |
> Alkaloids and derivatives / Harmala alkaloids
|
Harmalan
|
160510 |
Click to see
CC1=NCCC2=C1NC3=CC=CC=C23
|
184.24 |
unknown |
https://doi.org/10.1002/CHIN.200612187 |
Harman
|
5281404 |
Click to see
CC1=NC=CC2=C1NC3=CC=CC=C23
|
182.22 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acyl glycosides / Fatty acyl glycosides of mono- and disaccharides
|
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/10.1248/CPB.53.1355 |
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/10.1248/CPB.53.1355 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides
|
3-ethenyl-4-(2-hydroxyethyl)-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylic acid
|
73031194 |
Click to see
C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)O)CCO
|
376.36 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
3-ethenyl-4-(9H-pyrido[3,4-b]indol-1-ylmethyl)-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylic acid
|
23757137 |
Click to see
C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)O)CC3=NC=CC4=C3NC5=CC=CC=C45
|
512.50 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
Demethylsecologanol
|
11617742 |
Click to see
C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)O)CCO
|
376.36 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
Lyalosidic acid
|
10391678 |
Click to see
C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)O)CC3=NC=CC4=C3NC5=CC=CC=C45
|
512.50 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Iridoid O-glycosides
|
(1S,4aS,6S,7R,7aR)-6-hydroxy-7-methyl-1-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid
|
154496917 |
Click to see
CC1C(CC2C1C(OC=C2C(=O)O)OC3C(C(C(C(O3)CO)O)O)O)O
|
376.36 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
(1S,4aS,6S,7R,7aR)-6-hydroxy-7-methyl-1-[(3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid
|
163193095 |
Click to see
CC1C(CC2C1C(OC=C2C(=O)O)OC3C(C(C(C(O3)CO)O)O)O)O
|
376.36 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
6-Hydroxy-7-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid
|
4430509 |
Click to see
CC1C(CC2C1C(OC=C2C(=O)O)OC3C(C(C(C(O3)CO)O)O)O)O
|
376.36 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
Cyclopenta[c]pyran-4-carboxylic acid, 1-(beta-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-6-[(3-hydroxybenzoyl)oxy]-7-methyl-, (1S,4aS,6R,7R,7aS)-
|
162881314 |
Click to see
CC1C(CC2C1C(OC=C2C(=O)O)OC3C(C(C(C(O3)CO)O)O)O)OC(=O)C4=CC(=CC=C4)O
|
496.50 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
Loganic acid
|
89640 |
Click to see
CC1C(CC2C1C(OC=C2C(=O)O)OC3C(C(C(C(O3)CO)O)O)O)O
|
376.36 |
unknown |
https://doi.org/10.1002/CHIN.200612187 https://doi.org/10.1248/CPB.53.1355 |
Loganin
|
87691 |
Click to see
CC1C(CC2C1C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)O
|
390.40 |
unknown |
https://doi.org/10.1248/CPB.53.1355 https://doi.org/10.1002/CHIN.200612187 |
Methyl 6-hydroxy-7-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate
|
601562 |
Click to see
CC1C(CC2C1C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)O
|
390.40 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
Swertiaside
|
101285202 |
Click to see
CC1C(CC2C1C(OC=C2C(=O)O)OC3C(C(C(C(O3)CO)O)O)O)OC(=O)C4=CC(=CC=C4)O
|
496.50 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
|
beta-Ursolic acid
|
220774 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O
|
456.70 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
Ursolic Acid
|
64945 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O
|
456.70 |
unknown |
https://doi.org/10.1002/CHIN.200612187 https://doi.org/10.1248/CPB.53.1355 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
|
(2R,3R,4S,5S,6S)-2-[[(3S,8S,9S,10R,13R,14S,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-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
154496016 |
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/10.1248/CPB.53.1355 |
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/10.1248/CPB.53.1355 |
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/10.1002/CHIN.200612187 |
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/10.1248/CPB.53.1355 |
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/10.1248/CPB.53.1355 https://doi.org/10.1002/CHIN.200612187 |
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/10.1248/CPB.53.1355 |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives
|
3-[3-(3,4-Dihydroxyphenyl)prop-2-enoyloxy]-1,4,5-trihydroxy-cyclohexanecarboxylic 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/10.1248/CPB.53.1355 |
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/10.1248/CPB.53.1355 https://doi.org/10.1002/CHIN.200612187 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds
|
(3R)-Deoxypumiloside
|
11420564 |
Click to see
C=CC1C2CC3C4=NC5=CC=CC=C5C=C4CN3C(=O)C2=COC1OC6C(C(C(C(O6)CO)O)O)O
|
496.50 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
(3S,4R,4aS)-4-ethenyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-8-one
|
354447 |
Click to see
C=CC1C2CCOC(=O)C2=COC1OC3C(C(C(C(O3)CO)O)O)O
|
358.34 |
unknown |
https://doi.org/10.1002/CHIN.200612187 |
19-Ethenyl-18-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-2,4,6,8,10,15-hexaen-14-one
|
2989 |
Click to see
C=CC1C2CC3C4=NC5=CC=CC=C5C=C4CN3C(=O)C2=COC1OC6C(C(C(C(O6)CO)O)O)O
|
496.50 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
19-Ethenyl-18-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-2(11),4,6,8,15-pentaene-10,14-dione
|
14440700 |
Click to see
C=CC1C2CC3C4=C(CN3C(=O)C2=COC1OC5C(C(C(C(O5)CO)O)O)O)C(=O)C6=CC=CC=C6N4
|
512.50 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
4-ethenyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-8-one
|
581257 |
Click to see
C=CC1C2CCOC(=O)C2=COC1OC3C(C(C(C(O3)CO)O)O)O
|
358.34 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
7-epi-Vogeloside; Epivogeloside; Isovogeloside; Nervoside
|
14192588 |
Click to see
COC1CC2C(C(OC=C2C(=O)O1)OC3C(C(C(C(O3)CO)O)O)O)C=C
|
388.40 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
Epivogeloside
|
14192590 |
Click to see
COC1CC2C(C(OC=C2C(=O)O1)OC3C(C(C(C(O3)CO)O)O)O)C=C
|
388.40 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
Pumiloside
|
10346314 |
Click to see
C=CC1C2CC3C4=C(CN3C(=O)C2=COC1OC5C(C(C(C(O5)CO)O)O)O)C(=O)C6=CC=CC=C6N4
|
512.50 |
unknown |
https://doi.org/10.1002/CHIN.200612187 https://doi.org/10.1248/CPB.53.1355 |
Sweroside
|
161036 |
Click to see
C=CC1C2CCOC(=O)C2=COC1OC3C(C(C(C(O3)CO)O)O)O
|
358.34 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
> Organoheterocyclic compounds / Heteroaromatic compounds
|
(4S,5E,7S,10R,11R)-7,11-dimethyl-4-propan-2-yl-14-oxabicyclo[11.2.1]hexadeca-1(15),5,13(16)-triene-7,10,11-triol
|
16216286 |
Click to see
CC(C)C1CCC2=COC(=C2)CC(C(CCC(C=C1)(C)O)O)(C)O
|
336.50 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
> Organoheterocyclic compounds / Indoles and derivatives / Pyridoindoles / Beta carbolines
|
17-Ethenyl-18-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-19-oxa-2,12-diazapentacyclo[14.3.1.02,14.05,13.06,11]icosa-3,5,7,9,11,13-hexaene-20-carboxylic acid
|
163192292 |
Click to see
C=CC1C2CC3=C4C(=C5C=CC=CC5=N4)C=CN3C(C2C(=O)O)OC1OC6C(C(C(C(O6)CO)O)O)O
|
512.50 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
3-epi-Vincosamide; Isovincoside lactam; Strictosidine lactam
|
5015264 |
Click to see
C=CC1C2CC3C4=C(CCN3C(=O)C2=COC1OC5C(C(C(C(O5)CO)O)O)O)C6=CC=CC=C6N4
|
498.50 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
Strictosamide
|
10345799 |
Click to see
C=CC1C2CC3C4=C(CCN3C(=O)C2=COC1OC5C(C(C(C(O5)CO)O)O)O)C6=CC=CC=C6N4
|
498.50 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 7-hydroxycoumarins
|
Scopoletin
|
5280460 |
Click to see
COC1=C(C=C2C(=C1)C=CC(=O)O2)O
|
192.17 |
unknown |
https://doi.org/10.1248/CPB.53.1355 https://doi.org/10.1002/CHIN.200612187 |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
|
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
|
5378597 |
Click to see
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O
|
464.40 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3S,4R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
|
51521831 |
Click to see
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O
|
464.40 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
Hyperoside
|
5281643 |
Click to see
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O
|
464.40 |
unknown |
https://doi.org/10.1002/CHIN.200612187 https://doi.org/10.1248/CPB.53.1355 |
> Phenylpropanoids and polyketides / Tannins / Hydrolyzable tannins
|
(1S,4aS,6R,7R,7aS)-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[3-[3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoyl]oxybenzoyl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid
|
11411716 |
Click to see
CC1C(CC2C1C(OC=C2C(=O)O)OC3C(C(C(C(O3)CO)O)O)O)OC(=O)C4=CC(=CC=C4)OC(=O)C5=CC(=CC=C5)OC6C(C(C(C(O6)CO)O)O)O
|
778.70 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
(1S,4aS,7R,7aS)-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[3-[3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoyl]oxybenzoyl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid
|
101859085 |
Click to see
CC1C(CC2C1C(OC=C2C(=O)O)OC3C(C(C(C(O3)CO)O)O)O)OC(=O)C4=CC(=CC=C4)OC(=O)C5=CC(=CC=C5)OC6C(C(C(C(O6)CO)O)O)O
|
778.70 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |
7-Methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[3-[3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoyl]oxybenzoyl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid
|
72951325 |
Click to see
CC1C(CC2C1C(OC=C2C(=O)O)OC3C(C(C(C(O3)CO)O)O)O)OC(=O)C4=CC(=CC=C4)OC(=O)C5=CC(=CC=C5)OC6C(C(C(C(O6)CO)O)O)O
|
778.70 |
unknown |
https://doi.org/10.1248/CPB.53.1355 |