Glycoside
GD130648
Name:
2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxy-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]methyl}-4H-chromen-4-oneFormula:
C23H24O11Smiles:
COc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1CC1OC(CO)C(O)C(O)C1OAglycone:
COc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.35 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 5 |
| MolWt: | 476.43 | Num_heavy_atoms: | 34 |
| TPSA: | 190.28 | NumAromaticRings: | 3 |
Unique Aglycone
AD52941
Formula: C17H14O6
Smiles:
COc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1C| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.12 |
| AlogP: | 2.89 | Num_rotatable_bonds: | 2 |
| MolWt: | 314.29 | Num_heavy_atoms: | 23 |
| TPSA: | 100.13 | NumAromaticRings: | 3 |
