Glycoside
GD151445
Name:
3,4,5-trihydroxy-6-[(8-hydroxy-2-oxo-2H-chromen-7-yl)oxy]oxane-2-carboxylic acidFormula:
C15H14O10Smiles:
O=C(O)C1OC(Oc2ccc3ccc(=O)oc3c2O)C(O)C(O)C1OAglycone:
O=c1ccc2ccc(O)c(O)c2o1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -1.23 | Num_rotatable_bonds: | 3 |
| MolWt: | 354.27 | Num_heavy_atoms: | 25 |
| TPSA: | 166.89 | NumAromaticRings: | 2 |
Unique Aglycone
AD10122
Formula: C9H6O4
Smiles:
O=c1ccc2ccc(O)c(O)c2o1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 0 |
| MolWt: | 178.14 | Num_heavy_atoms: | 13 |
| TPSA: | 70.67 | NumAromaticRings: | 2 |
