> Benzenoids / Anthracenes
|
(10S)-10-[(9R)-4,5-dihydroxy-2-methyl-10-oxo-9H-anthracen-9-yl]-1,3,8-trihydroxy-6-methyl-10H-anthracen-9-one
|
44567184 |
Click to see
CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC(=C5)C)O)C(=O)C6=C4C=C(C=C6O)O)C=CC=C3O
|
494.50 |
unknown |
via CMAUP database |
> Benzenoids / Anthracenes / Anthracenecarboxylic acids and derivatives / Anthracenecarboxylic acids
|
4-hydroxy-9,10-dioxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(oxalooxymethyl)oxan-2-yl]oxyanthracene-2-carboxylic acid
|
11972451 |
Click to see
C1=CC2=C(C(=C1)OC3C(C(C(C(O3)COC(=O)C(=O)O)O)O)O)C(=O)C4=C(C2=O)C=C(C=C4O)C(=O)O
|
518.40 |
unknown |
via CMAUP database |
Rhein
|
10168 |
Click to see
C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)C(=O)O
|
284.22 |
unknown |
via CMAUP database |
Rhein-8-glucoside
|
5320961 |
Click to see
C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2=O)C=C(C=C4O)C(=O)O
|
446.40 |
unknown |
via CMAUP database |
Sennidin A
|
92826 |
Click to see
C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC=C5)O)C(=O)C6=C4C=C(C=C6O)C(=O)O)C=C(C=C3O)C(=O)O
|
538.50 |
unknown |
via CMAUP database |
Sennoside A
|
73111 |
Click to see
C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O
|
862.70 |
unknown |
via CMAUP database |
Sennoside C
|
46173829 |
Click to see
C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)CO
|
848.80 |
unknown |
via CMAUP database |
> Benzenoids / Anthracenes / Anthraquinones
|
1-hydroxy-3-methoxy-6-methyl-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyanthracene-9,10-dione
|
5320543 |
Click to see
CC1=CC2=C(C(=C1)OC3C(C(C(C(O3)COC4C(C(C(C(O4)CO)O)O)O)O)O)O)C(=O)C5=C(C2=O)C=C(C=C5O)OC
|
608.50 |
unknown |
via CMAUP database |
Aloe emodin
|
10207 |
Click to see
C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)CO
|
270.24 |
unknown |
via CMAUP database |
Aloe-emodin-glucoside
|
147295 |
Click to see
C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)COC4C(C(C(C(O4)CO)O)O)O
|
432.40 |
unknown |
via CMAUP database |
Chrysophanein
|
6324923 |
Click to see
CC1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2=O)C=CC=C4O
|
416.40 |
unknown |
via CMAUP database |
Chrysophanic acid
|
10208 |
Click to see
CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=CC=C3O
|
254.24 |
unknown |
via CMAUP database |
Physcione
|
10639 |
Click to see
CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)OC
|
284.26 |
unknown |
via CMAUP database |
Pulmatin
|
442731 |
Click to see
CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=CC=C3OC4C(C(C(C(O4)CO)O)O)O
|
416.40 |
unknown |
via CMAUP database |
Rheochrysin
|
168938 |
Click to see
CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3OC4C(C(C(C(O4)CO)O)O)O)OC
|
446.40 |
unknown |
via CMAUP database |
> Benzenoids / Anthracenes / Anthraquinones / Hydroxyanthraquinones
|
Emodin
|
3220 |
Click to see
CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)O
|
270.24 |
unknown |
via CMAUP database |
Emodin 1-O-beta-D-glucoside
|
5319333 |
Click to see
CC1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2=O)C=C(C=C4O)O
|
432.40 |
unknown |
via CMAUP database |
Emodin-8-glucoside
|
99649 |
Click to see
CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3OC4C(C(C(C(O4)CO)O)O)O)O
|
432.40 |
unknown |
via CMAUP database |
> 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 |
via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives / Galloyl esters
|
[(2S)-2,3-dihydroxypropyl] 3,4,5-trihydroxybenzoate
|
51543740 |
Click to see
C1=C(C=C(C(=C1O)O)O)C(=O)OCC(CO)O
|
244.20 |
unknown |
via CMAUP database |
6-O-galloyl-beta-D-glucose
|
5317463 |
Click to see
C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(C(O2)O)O)O)O
|
332.26 |
unknown |
via CMAUP database |
Methyl gallate
|
7428 |
Click to see
COC(=O)C1=CC(=C(C(=C1)O)O)O
|
184.15 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids
|
(2S,3R,4R,5R,6S)-2-[(3S)-5-[(1S,2R,4aS,5R,8aR)-2-hydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-yl]oxy-6-methyloxane-3,4,5-triol
|
162986541 |
Click to see
CC1C(C(C(C(O1)OC(C)(CCC2C3(CCCC(C3CCC2(C)O)(C)CO)C)C=C)O)O)O
|
470.60 |
unknown |
https://doi.org/10.1021/NP070119M |
(2S,3R,4S,5S,6R)-2-[(2S,3R,4R,5R,6S)-2-[(3S)-5-[(1S,2R,4aS,5R,8aR)-2-hydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-yl]oxy-4,5-dihydroxy-6-methyloxan-3-yl]oxy-6-methyloxane-3,4,5-triol
|
101838046 |
Click to see
CC1C(C(C(C(O1)OC2C(C(C(OC2OC(C)(CCC3C4(CCCC(C4CCC3(C)O)(C)CO)C)C=C)C)O)O)O)O)O
|
616.80 |
unknown |
https://doi.org/10.1021/NP070119M |
(2S,3R,4S,5S,6R)-2-[(2S,3R,4R,5R,6S)-2-[(3S)-5-[(1S,2R,4aS,6R,8aR)-2,6-dihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-yl]oxy-4,5-dihydroxy-6-methyloxan-3-yl]oxy-6-methyloxane-3,4,5-triol
|
101838047 |
Click to see
CC1C(C(C(C(O1)OC2C(C(C(OC2OC(C)(CCC3C4(CCC(C(C4CCC3(C)O)(C)C)O)C)C=C)C)O)O)O)O)O
|
616.80 |
unknown |
https://doi.org/10.1021/NP070119M |
2-[2-[5-(2,6-dihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpent-1-en-3-yl]oxy-4,5-dihydroxy-6-methyloxan-3-yl]oxy-6-methyloxane-3,4,5-triol
|
163021320 |
Click to see
CC1C(C(C(C(O1)OC2C(C(C(OC2OC(C)(CCC3C4(CCC(C(C4CCC3(C)O)(C)C)O)C)C=C)C)O)O)O)O)O
|
616.80 |
unknown |
https://doi.org/10.1021/NP070119M |
2-[4,5-dihydroxy-2-[5-[2-hydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-yl]oxy-6-methyloxan-3-yl]oxy-6-methyloxane-3,4,5-triol
|
162881994 |
Click to see
CC1C(C(C(C(O1)OC2C(C(C(OC2OC(C)(CCC3C4(CCCC(C4CCC3(C)O)(C)CO)C)C=C)C)O)O)O)O)O
|
616.80 |
unknown |
https://doi.org/10.1021/NP070119M |
2-[5-[2-hydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-yl]oxy-6-methyloxane-3,4,5-triol
|
162986540 |
Click to see
CC1C(C(C(C(O1)OC(C)(CCC2C3(CCCC(C3CCC2(C)O)(C)CO)C)C=C)O)O)O
|
470.60 |
unknown |
https://doi.org/10.1021/NP070119M |
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Diterpene glycosides
|
(2R,3R,4R,5R,6S)-2-[[(1R,4aR,5S,6R,8aS)-5-[(3S)-3-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-6-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-3-methylpent-4-enyl]-6-hydroxy-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methoxy]-6-methyloxane-3,4,5-triol
|
101838049 |
Click to see
CC1C(C(C(C(O1)OCC2(CCCC3(C2CCC(C3CCC(C)(C=C)OC4C(C(C(C(O4)C)O)O)OC5C(C(C(C(O5)C)O)O)O)(C)O)C)C)O)O)O
|
762.90 |
unknown |
https://doi.org/10.1021/NP070119M |
(2R,3R,4R,5R,6S)-2-[[(1R,4aR,5S,6R,8aS)-6-hydroxy-1,4a,6-trimethyl-5-[(3S)-3-methyl-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxypent-4-enyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methoxy]-6-methyloxane-3,4,5-triol
|
163086102 |
Click to see
CC1C(C(C(C(O1)OCC2(CCCC3(C2CCC(C3CCC(C)(C=C)OC4C(C(C(C(O4)C)O)O)O)(C)O)C)C)O)O)O
|
616.80 |
unknown |
https://doi.org/10.1021/NP070119M |
(2R,3R,4R,5R,6S)-2-[[(1R,4aR,5S,6R,8aS)-6-hydroxy-1,4a,6-trimethyl-5-[(3S)-3-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypent-4-enyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methoxy]-6-methyloxane-3,4,5-triol
|
162993007 |
Click to see
CC1C(C(C(C(O1)OCC2(CCCC3(C2CCC(C3CCC(C)(C=C)OC4C(C(C(C(O4)CO)O)O)O)(C)O)C)C)O)O)O
|
632.80 |
unknown |
https://doi.org/10.1021/NP070119M |
(2R,3R,4S,5S,6R)-2-[[(1R,4aR,5S,6R,8aS)-6-hydroxy-5-[(3S)-3-hydroxy-3-methylpent-4-enyl]-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
162981804 |
Click to see
CC1(CCCC2(C1CCC(C2CCC(C)(C=C)O)(C)O)C)COC3C(C(C(C(O3)CO)O)O)O
|
486.60 |
unknown |
https://doi.org/10.1021/NP070119M |
(2R,3R,4S,5S,6R)-2-[[(1R,4aR,5S,6S,8aS)-6-hydroxy-5-[(3S)-3-hydroxy-3-methylpent-4-enyl]-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
101838048 |
Click to see
CC1(CCCC2(C1CCC(C2CCC(C)(C=C)O)(C)O)C)COC3C(C(C(C(O3)CO)O)O)O
|
486.60 |
unknown |
https://doi.org/10.1021/NP070119M |
(2R,3R,4S,5S,6R)-2-[[(1S,3R,4S,4aR,8aR)-3,4,8,8a-tetramethyl-4-[(3R)-3-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypent-4-enyl]-1,2,3,4a,5,6-hexahydronaphthalen-1-yl]oxy]-6-methyloxane-3,4,5-triol
|
162999603 |
Click to see
CC1CC(C2(C(C1(C)CCC(C)(C=C)OC3C(C(C(C(O3)CO)O)O)O)CCC=C2C)C)OC4C(C(C(C(O4)C)O)O)O
|
614.80 |
unknown |
https://doi.org/10.1021/NP070119M |
(2S,3R,4S,5S,6R)-2-[(3S)-5-[(1S,2R,4aR,8aR)-2-hydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
|
101838045 |
Click to see
CC1(CCCC2(C1CCC(C2CCC(C)(C=C)OC3C(C(C(C(O3)CO)O)O)O)(C)O)C)C
|
470.60 |
unknown |
https://doi.org/10.1021/NP070119M |
(2S,3R,4S,5S,6R)-2-[(3S)-5-[(1S,2R,4aS,5R,8aR)-2-hydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
|
162923427 |
Click to see
CC1(CCCC2(C1CCC(C2CCC(C)(C=C)OC3C(C(C(C(O3)CO)O)O)O)(C)O)C)CO
|
486.60 |
unknown |
https://doi.org/10.1021/NP070119M |
(2S,3R,4S,5S,6R)-2-[(3S)-5-[(1S,2R,4aS,5S,8aR)-2-hydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
|
162923428 |
Click to see
CC1(CCCC2(C1CCC(C2CCC(C)(C=C)OC3C(C(C(C(O3)CO)O)O)O)(C)O)C)CO
|
486.60 |
unknown |
https://doi.org/10.1021/NP070119M |
(2S,3R,4S,5S,6R)-2-[(3S)-5-[(1S,2S,4aS,5R,8aR)-2-hydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
|
162923426 |
Click to see
CC1(CCCC2(C1CCC(C2CCC(C)(C=C)OC3C(C(C(C(O3)CO)O)O)O)(C)O)C)CO
|
486.60 |
unknown |
https://doi.org/10.1021/NP070119M |
[(2S,3R,4R,5S,6S)-2-[(3S)-5-[(1S,2R,4aS,5R,8aR)-2-hydroxy-2,5,8a-trimethyl-5-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-yl]oxy-5-hydroxy-6-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-4-yl] acetate
|
163038803 |
Click to see
CC1C(C(C(C(O1)OCC2(CCCC3(C2CCC(C3CCC(C)(C=C)OC4C(C(C(C(O4)C)O)OC(=O)C)OC5C(C(C(C(O5)C)O)O)O)(C)O)C)C)O)O)O
|
805.00 |
unknown |
https://doi.org/10.1021/NP070119M |
[5-hydroxy-2-[5-[2-hydroxy-2,5,8a-trimethyl-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-yl]oxy-6-methyl-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-4-yl] acetate
|
163038802 |
Click to see
CC1C(C(C(C(O1)OCC2(CCCC3(C2CCC(C3CCC(C)(C=C)OC4C(C(C(C(O4)C)O)OC(=O)C)OC5C(C(C(C(O5)C)O)O)O)(C)O)C)C)O)O)O
|
805.00 |
unknown |
https://doi.org/10.1021/NP070119M |
2-[[3,4,8,8a-Tetramethyl-4-[3-methyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypent-4-enyl]-1,2,3,4a,5,6-hexahydronaphthalen-1-yl]oxy]-6-methyloxane-3,4,5-triol
|
162999602 |
Click to see
CC1CC(C2(C(C1(C)CCC(C)(C=C)OC3C(C(C(C(O3)CO)O)O)O)CCC=C2C)C)OC4C(C(C(C(O4)C)O)O)O
|
614.80 |
unknown |
https://doi.org/10.1021/NP070119M |
2-[[5-[3-[4,5-dihydroxy-6-methyl-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-3-methylpent-4-enyl]-6-hydroxy-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methoxy]-6-methyloxane-3,4,5-triol
|
163052428 |
Click to see
CC1C(C(C(C(O1)OCC2(CCCC3(C2CCC(C3CCC(C)(C=C)OC4C(C(C(C(O4)C)O)O)OC5C(C(C(C(O5)C)O)O)O)(C)O)C)C)O)O)O
|
762.90 |
unknown |
https://doi.org/10.1021/NP070119M |
2-[[6-hydroxy-1,4a,6-trimethyl-5-[3-methyl-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxypent-4-enyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methoxy]-6-methyloxane-3,4,5-triol
|
163086101 |
Click to see
CC1C(C(C(C(O1)OCC2(CCCC3(C2CCC(C3CCC(C)(C=C)OC4C(C(C(C(O4)C)O)O)O)(C)O)C)C)O)O)O
|
616.80 |
unknown |
https://doi.org/10.1021/NP070119M |
2-[[6-hydroxy-1,4a,6-trimethyl-5-[3-methyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypent-4-enyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methoxy]-6-methyloxane-3,4,5-triol
|
162993006 |
Click to see
CC1C(C(C(C(O1)OCC2(CCCC3(C2CCC(C3CCC(C)(C=C)OC4C(C(C(C(O4)CO)O)O)O)(C)O)C)C)O)O)O
|
632.80 |
unknown |
https://doi.org/10.1021/NP070119M |
2-[[6-hydroxy-5-(3-hydroxy-3-methylpent-4-enyl)-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
162981803 |
Click to see
CC1(CCCC2(C1CCC(C2CCC(C)(C=C)O)(C)O)C)COC3C(C(C(C(O3)CO)O)O)O
|
486.60 |
unknown |
https://doi.org/10.1021/NP070119M |
2-[5-(2-hydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpent-1-en-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
|
162897132 |
Click to see
CC1(CCCC2(C1CCC(C2CCC(C)(C=C)OC3C(C(C(C(O3)CO)O)O)O)(C)O)C)C
|
470.60 |
unknown |
https://doi.org/10.1021/NP070119M |
2-[5-[2-hydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
|
162923425 |
Click to see
CC1(CCCC2(C1CCC(C2CCC(C)(C=C)OC3C(C(C(C(O3)CO)O)O)O)(C)O)C)CO
|
486.60 |
unknown |
https://doi.org/10.1021/NP070119M |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Bile acids, alcohols and derivatives
|
[(2S,3R,5R,9R,10R,13R,14S,17S)-2,14-diacetyloxy-10,13-dimethyl-6-oxo-17-[(2R,3R)-2,3,6-triacetyloxy-6-methylheptan-2-yl]-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
|
163028748 |
Click to see
CC(=O)OC1CC2C(=O)C=C3C(C2(CC1OC(=O)C)C)CCC4(C3(CCC4C(C)(C(CCC(C)(C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)C
|
732.90 |
unknown |
https://doi.org/10.1021/NP070119M |
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alpha amino acids / L-alpha-amino acids
|
(2S)-5-amino-2-ammonio-5-oxopentanoate
|
6992086 |
Click to see
C(CC(=O)N)C(C(=O)[O-])[NH3+]
|
146.14 |
unknown |
via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides
|
1-[1-hydroxy-3-methyl-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynaphthalen-2-yl]ethanone
|
5319972 |
Click to see
CC1=CC2=C(C(=CC=C2)OC3C(C(C(C(O3)CO)O)O)O)C(=C1C(=O)C)O
|
378.40 |
unknown |
via CMAUP database |
1-[1,6-dihydroxy-3-methyl-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynaphthalen-2-yl]ethanone
|
100753 |
Click to see
CC1=CC2=CC(=CC(=C2C(=C1C(=O)C)O)OC3C(C(C(C(O3)CO)O)O)O)O
|
394.40 |
unknown |
via CMAUP database |
2-[[(2R,3S,4S,5R,6S)-6-(7-acetyl-8-hydroxy-3-methoxy-6-methylnaphthalen-1-yl)oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-2-oxoacetic acid
|
5321979 |
Click to see
CC1=CC2=CC(=CC(=C2C(=C1C(=O)C)O)OC3C(C(C(C(O3)COC(=O)C(=O)O)O)O)O)OC
|
480.40 |
unknown |
via CMAUP database |
2-methyl-4-oxo-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromene-5-carboxylic acid
|
5315687 |
Click to see
CC1=CC(=O)C2=C(C=C(C=C2O1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)O
|
382.30 |
unknown |
via CMAUP database |
3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[(3,4,5-trihydroxybenzoyl)oxymethyl]oxan-2-yl]oxybenzoic acid
|
11972354 |
Click to see
C1=C(C=C(C(=C1O)OC2C(C(C(C(O2)COC(=O)C3=CC(=C(C(=C3)O)O)O)O)O)O)O)C(=O)O
|
484.40 |
unknown |
via CMAUP database |
Raspberryketone glucoside
|
5320521 |
Click to see
CC(=O)CCC1=CC=C(C=C1)OC2C(C(C(C(O2)CO)O)O)O
|
326.34 |
unknown |
via CMAUP database |
Torachrysone 8-O-Glucoside
|
11972479 |
Click to see
CC1=CC2=CC(=CC(=C2C(=C1C(=O)C)O)OC3C(C(C(C(O3)CO)O)O)O)OC
|
408.40 |
unknown |
via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides / Hexoses
|
[(2R,3R,4S,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl] (E)-3-phenylprop-2-enoate
|
11972309 |
Click to see
C1=CC=C(C=C1)C=CC(=O)OC2C(C(C(OC2O)CO)O)O
|
310.30 |
unknown |
via CMAUP database |
> Organoheterocyclic compounds / Benzopyrans / 1-benzopyrans / Chromones
|
2H-1-Benzopyran-5-acetic acid, 3,4-dihydro-7-hydroxy-2-methyl-4-oxo-, (S)-
|
5319543 |
Click to see
CC1CC(=O)C2=C(C=C(C=C2O1)O)CC(=O)O
|
236.22 |
unknown |
via CMAUP database |
4H-1-Benzopyran-4-one, 5-acetyl-7-hydroxy-2-methyl-
|
5315891 |
Click to see
CC1=CC(=O)C2=C(C=C(C=C2O1)O)C(=O)C
|
218.20 |
unknown |
via CMAUP database |
7-Hydroxy-2-[(2S)-2-hydroxypropyl]-5-methyl-4H-1-benzopyran-4-one
|
45272307 |
Click to see
CC1=CC(=CC2=C1C(=O)C=C(O2)CC(C)O)O
|
234.25 |
unknown |
via CMAUP database |
7-Hydroxy-2-methyl-4-oxo-4H-1-benzopyran-5-acetic acid
|
14429402 |
Click to see
CC1=CC(=O)C2=C(C=C(C=C2O1)O)CC(=O)O
|
234.20 |
unknown |
via CMAUP database |
7-Hydroxy-2-methyl-4-oxo-4H-1-benzopyran-5-carboxylic acid
|
5315688 |
Click to see
CC1=CC(=O)C2=C(C=C(C=C2O1)O)C(=O)O
|
220.18 |
unknown |
via CMAUP database |
Cassiachromone
|
5319500 |
Click to see
CC1=CC(=O)C2=C(C=C(C=C2O1)O)CC(=O)C
|
232.23 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Biflavonoids and polyflavonoids
|
3,3'-Digalloylprocyanidin B2
|
124016 |
Click to see
C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O)O)O)C7=CC(=C(C=C7)O)O)OC(=O)C8=CC(=C(C(=C8)O)O)O
|
882.70 |
unknown |
via CMAUP database |
procyanidin B1 3-O-gallate
|
12795888 |
Click to see
C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O)O)O)C7=CC(=C(C=C7)O)O)O
|
730.60 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins / Catechin gallates
|
(-)-Epicatechin gallate
|
107905 |
Click to see
C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O
|
442.40 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides
|
(+)-Catechin-5-O-I(2)-D-glucopyranoside
|
6324898 |
Click to see
C1C(C(OC2=C1C(=CC(=C2)O)OC3C(C(C(C(O3)CO)O)O)O)C4=CC(=C(C=C4)O)O)O
|
452.40 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
|
Afzelin
|
5316673 |
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
|
432.40 |
unknown |
https://doi.org/10.1021/NP070119M |
Kaempferol-3-O-rhamnoside
|
5835713 |
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
|
432.40 |
unknown |
https://doi.org/10.1021/NP070119M |
Rutin
|
5280805 |
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)O)O)O)O)O)O)O
|
610.50 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Stilbenes
|
Rhapontigenin
|
5320954 |
Click to see
COC1=C(C=C(C=C1)C=CC2=CC(=CC(=C2)O)O)O
|
258.27 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Stilbenes / Stilbene glycosides
|
[(2R,3S,4S,5R,6S)-6-[4-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]phenoxy]-3,4,5-trihydroxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate
|
5322088 |
Click to see
C1=CC(=CC=C1C=CC2=CC(=CC(=C2)O)O)OC3C(C(C(C(O3)COC(=O)C4=CC(=C(C(=C4)O)O)O)O)O)O
|
542.50 |
unknown |
via CMAUP database |
Resveratrol 4'-O-beta-D-(2''-O-galloyl)-glucopyranoside
|
10325054 |
Click to see
C1=CC(=CC=C1C=CC2=CC(=CC(=C2)O)O)OC3C(C(C(C(O3)CO)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O
|
542.50 |
unknown |
via CMAUP database |
Resveratroloside
|
5322089 |
Click to see
C1=CC(=CC=C1C=CC2=CC(=CC(=C2)O)O)OC3C(C(C(C(O3)CO)O)O)O
|
390.40 |
unknown |
via CMAUP database |
Rhapontin
|
637213 |
Click to see
COC1=C(C=C(C=C1)C=CC2=CC(=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O
|
420.40 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Tannins
|
1,2,6-Trigalloylglucose
|
440308 |
Click to see
C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)O)O
|
636.50 |
unknown |
via CMAUP database |
1,6-bis-O-galloyl-beta-D-glucose
|
440221 |
Click to see
C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)O)O)O
|
484.40 |
unknown |
via CMAUP database |
2-Cinnamoyl-1-galloylglucose
|
5315898 |
Click to see
C1=CC=C(C=C1)C=CC(=O)OC2C(C(C(OC2OC(=O)C3=CC(=C(C(=C3)O)O)O)CO)O)O
|
462.40 |
unknown |
via CMAUP database |
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 |
via CMAUP database |
I(2)-D-Glucopyranose, 2-[(2E)-3-phenyl-2-propenoate] 1,6-bis(3,4,5-trihydroxybenzoate)
|
6325082 |
Click to see
C1=CC=C(C=C1)C=CC(=O)OC2C(C(C(OC2OC(=O)C3=CC(=C(C(=C3)O)O)O)COC(=O)C4=CC(=C(C(=C4)O)O)O)O)O
|
614.50 |
unknown |
via CMAUP database |