Glycoside
GD149836
Name:
5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl 3-(4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoateFormula:
C30H26O12Smiles:
O=C(C=Cc1ccc(OC2OC(CO)C(O)C(O)C2O)cc1)Oc1cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1Aglycone:
O=C(C=Cc1ccc(O)cc1)Oc1cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.2 |
| AlogP: | 1.67 | Num_rotatable_bonds: | 7 |
| MolWt: | 578.53 | Num_heavy_atoms: | 42 |
| TPSA: | 196.35 | NumAromaticRings: | 4 |
Unique Aglycone
AD59893
Formula: C24H16O7
Smiles:
O=C(C=Cc1ccc(O)cc1)Oc1cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 4.2 | Num_rotatable_bonds: | 4 |
| MolWt: | 416.39 | Num_heavy_atoms: | 31 |
| TPSA: | 117.2 | NumAromaticRings: | 4 |
