> 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/10.1248/CPB.37.2621 |
Beta-Amyrin
|
73145 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C)C
|
426.70 |
unknown |
https://doi.org/10.1248/CPB.37.2621 |
> Nucleosides, nucleotides, and analogues / Purine nucleosides
|
N-benzyl-9-[(2R,3R,4R,5R)-3,4-dimethoxy-5-[[(2R,3R,4S,5R,6R)-3,4,5-trimethoxy-6-(methoxymethyl)oxan-2-yl]oxymethyl]oxolan-2-yl]-N-methylpurin-6-amine
|
14779582 |
Click to see
CN(CC1=CC=CC=C1)C2=NC=NC3=C2N=CN3C4C(C(C(O4)COC5C(C(C(C(O5)COC)OC)OC)OC)OC)OC
|
617.70 |
unknown |
https://doi.org/10.1016/0031-9422(91)83689-I |
N-benzyl-9-[3,4-dimethoxy-5-[[3,4,5-trimethoxy-6-(methoxymethyl)oxan-2-yl]oxymethyl]oxolan-2-yl]-N-methylpurin-6-amine
|
14779581 |
Click to see
CN(CC1=CC=CC=C1)C2=NC=NC3=C2N=CN3C4C(C(C(O4)COC5C(C(C(C(O5)COC)OC)OC)OC)OC)OC
|
617.70 |
unknown |
https://doi.org/10.1016/0031-9422(91)83689-I |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Cyanogenic glycosides
|
(2R)-2-phenyl-2-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyacetonitrile
|
154497290 |
Click to see
C1=CC=C(C=C1)C(C#N)OC2C(C(C(C(O2)CO)O)O)O
|
295.29 |
unknown |
https://doi.org/10.1248/CPB.33.4803 |
(2R)-2-phenyl-2-[(4S,5S)-3,4,5-trihydroxy-6-[[(3R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyacetonitrile
|
134694146 |
Click to see
C1=CC=C(C=C1)C(C#N)OC2C(C(C(C(O2)COC3C(C(C(C(O3)CO)O)O)O)O)O)O
|
457.40 |
unknown |
https://doi.org/10.1248/CPB.37.2621 https://doi.org/10.1248/CPB.33.4803 |
(S)-2-Hydroxy-2-phenylacetonitrile O-b-D-allopyranoside
|
576072 |
Click to see
C1=CC=C(C=C1)C(C#N)OC2C(C(C(C(O2)CO)O)O)O
|
295.29 |
unknown |
https://doi.org/10.1016/S0031-9422(00)91069-0 |
Amygdalin
|
656516 |
Click to see
C1=CC=C(C=C1)C(C#N)OC2C(C(C(C(O2)COC3C(C(C(C(O3)CO)O)O)O)O)O)O
|
457.40 |
unknown |
https://doi.org/10.1248/CPB.33.4803 https://doi.org/10.1248/CPB.37.2621 |
Prulaurasin
|
120639 |
Click to see
C1=CC=C(C=C1)C(C#N)OC2C(C(C(C(O2)CO)O)O)O
|
295.29 |
unknown |
https://doi.org/10.1016/S0031-9422(00)91069-0 |
Prunasin
|
119033 |
Click to see
C1=CC=C(C=C1)C(C#N)OC2C(C(C(C(O2)CO)O)O)O
|
295.29 |
unknown |
https://doi.org/10.1248/CPB.37.2621 https://doi.org/10.1248/CPB.33.4803 |
Sambunigrin
|
91434 |
Click to see
C1=CC=C(C=C1)C(C#N)OC2C(C(C(C(O2)CO)O)O)O
|
295.29 |
unknown |
https://doi.org/10.1016/S0031-9422(00)91069-0 |
Vicianin
|
656493 |
Click to see
C1C(C(C(C(O1)OCC2C(C(C(C(O2)OC(C#N)C3=CC=CC=C3)O)O)O)O)O)O
|
427.40 |
unknown |
https://doi.org/10.1248/CPB.33.4803 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds
|
(2R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-3-yl]oxy-2-phenylacetonitrile
|
163007200 |
Click to see
C1=CC=C(C=C1)C(C#N)OC2C(OC(C(C2O)O)OCC3C(C(C(C(O3)O)O)O)O)CO
|
457.40 |
unknown |
https://doi.org/10.1248/CPB.33.4803 |
(2R)-2-[(3S,4R,5R,6R)-4,5-dihydroxy-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-3-yl]oxy-2-phenylacetonitrile
|
162887618 |
Click to see
C1C(C(C(C(O1)OCC2C(C(C(C(O2)O)O)O)O)O)O)OC(C#N)C3=CC=CC=C3
|
427.40 |
unknown |
https://doi.org/10.1248/CPB.33.4803 |
2-[4,5-Dihydroxy-2-(hydroxymethyl)-6-[(3,4,5,6-tetrahydroxyoxan-2-yl)methoxy]oxan-3-yl]oxy-2-phenylacetonitrile
|
163007199 |
Click to see
C1=CC=C(C=C1)C(C#N)OC2C(OC(C(C2O)O)OCC3C(C(C(C(O3)O)O)O)O)CO
|
457.40 |
unknown |
https://doi.org/10.1248/CPB.33.4803 |
2-[4,5-Dihydroxy-6-[(3,4,5,6-tetrahydroxyoxan-2-yl)methoxy]oxan-3-yl]oxy-2-phenylacetonitrile
|
162887617 |
Click to see
C1C(C(C(C(O1)OCC2C(C(C(C(O2)O)O)O)O)O)O)OC(C#N)C3=CC=CC=C3
|
427.40 |
unknown |
https://doi.org/10.1248/CPB.33.4803 |
2-Methyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydropyran-6-one
|
14483165 |
Click to see
CC1CC(=CC(=O)O1)OC2C(C(C(C(O2)CO)O)O)O
|
290.27 |
unknown |
https://doi.org/10.1248/CPB.37.2621 |
Gerberin
|
3050415 |
Click to see
CC1CC(=CC(=O)O1)OC2C(C(C(C(O2)CO)O)O)O
|
290.27 |
unknown |
https://doi.org/10.1248/CPB.37.2621 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides / Hexoses
|
(2R)-2-phenyl-2-[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyacetonitrile
|
163088158 |
Click to see
C1=CC=C(C=C1)C(C#N)OC2C(OC(C(C2O)O)O)CO
|
295.29 |
unknown |
https://doi.org/10.1248/CPB.33.4803 |
2-Phenyl-2-[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyacetonitrile
|
163088157 |
Click to see
C1=CC=C(C=C1)C(C#N)OC2C(OC(C(C2O)O)O)CO
|
295.29 |
unknown |
https://doi.org/10.1248/CPB.33.4803 |
5-methyl-4-[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxychromen-2-one
|
162940556 |
Click to see
CC1=C2C(=CC=C1)OC(=O)C=C2OC3C(OC(C(C3O)O)O)CO
|
338.31 |
unknown |
https://doi.org/10.1248/CPB.33.4803 |
5-Methyl-4-[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxychromen-2-one
|
162940555 |
Click to see
CC1=C2C(=CC=C1)OC(=O)C=C2OC3C(OC(C(C3O)O)O)CO
|
338.31 |
unknown |
https://doi.org/10.1248/CPB.33.4803 |
> Organoheterocyclic compounds / Imidazopyrimidines / Purines and purine derivatives / 6-aminopurines
|
US9138393, 3-Benzyladenine
|
15986830 |
Click to see
C1=CC=C(C=C1)CC2=NC(=C3C(=N2)N=CN3)N
|
225.25 |
unknown |
https://doi.org/10.1016/0031-9422(91)83689-I |
> Phenylpropanoids and polyketides / Coumarins and derivatives
|
4-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-2-methyl-6-[[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-3-yl]oxy-5-methylchromen-2-one
|
163075312 |
Click to see
CC1C(C(C(C(O1)OCC2C(C(C(C(O2)O)O)O)O)O)O)OC3=CC(=O)OC4=CC=CC(=C43)C
|
484.40 |
unknown |
https://doi.org/10.1248/CPB.33.4803 |
4-[4,5-Dihydroxy-2-methyl-6-[(3,4,5,6-tetrahydroxyoxan-2-yl)methoxy]oxan-3-yl]oxy-5-methylchromen-2-one
|
163075311 |
Click to see
CC1C(C(C(C(O1)OCC2C(C(C(C(O2)O)O)O)O)O)O)OC3=CC(=O)OC4=CC=CC(=C43)C
|
484.40 |
unknown |
https://doi.org/10.1248/CPB.33.4803 |
5-Methyl-4-(3-methylbut-2-enoxy)chromen-2-one
|
122209058 |
Click to see
CC1=C2C(=CC=C1)OC(=O)C=C2OCC=C(C)C
|
244.28 |
unknown |
https://doi.org/10.1016/S0031-9422(00)97977-9 |
> Phenylpropanoids and polyketides / Coumarins and derivatives / Coumarin glycosides
|
6-hydroxy-5-methyl-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one
|
14483164 |
Click to see
CC1=C(C=CC2=C1C(=CC(=O)O2)OC3C(C(C(C(O3)CO)O)O)O)O
|
354.31 |
unknown |
https://doi.org/10.1248/CPB.37.2621 |
6-Hydroxy-5-methyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one
|
14483163 |
Click to see
CC1=C(C=CC2=C1C(=CC(=O)O2)OC3C(C(C(C(O3)CO)O)O)O)O
|
354.31 |
unknown |
https://doi.org/10.1248/CPB.37.2621 |
Gerberinside
|
196468 |
Click to see
CC1=C2C(=CC=C1)OC(=O)C=C2OC3C(C(C(C(O3)CO)O)O)O
|
338.31 |
unknown |
https://doi.org/10.1248/CPB.37.2621 |
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins
|
6-Hydroxy-4-methoxy-5-methylchromen-2-one
|
23260079 |
Click to see
CC1=C(C=CC2=C1C(=CC(=O)O2)OC)O
|
206.19 |
unknown |
https://doi.org/10.1016/S0031-9422(00)91069-0 |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides
|
Apigenin-4'-glucoside
|
5491384 |
Click to see
C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O
|
432.40 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84090-X |
Spiraeoside
|
5320844 |
Click to see
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)OC4C(C(C(C(O4)CO)O)O)O
|
464.40 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84090-X |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
|
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
|
51402807 |
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/10.1016/S0031-9422(00)84090-X |
Astragalin
|
5282102 |
Click to see
C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O
|
448.40 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84090-X |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides
|
Apigetrin
|
5280704 |
Click to see
C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O
|
432.40 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84090-X |
Luteolin 7-O-glucoside
|
5280637 |
Click to see
C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O)O
|
448.40 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84090-X |