Glycoside
GD117882
Name:
3,4,5-trihydroxy-6-[(2-oxo-2H-chromen-3-yl)oxy]oxane-2-carboxylic acidFormula:
C15H14O9Smiles:
O=C(O)C1OC(Oc2cc3ccccc3oc2=O)C(O)C(O)C1OAglycone:
O=c1oc2ccccc2cc1OSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | -0.94 | Num_rotatable_bonds: | 3 |
| MolWt: | 338.27 | Num_heavy_atoms: | 24 |
| TPSA: | 146.66 | NumAromaticRings: | 2 |
Unique Aglycone
AD47064
Formula: C9H6O3
Smiles:
O=c1oc2ccccc2cc1O| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.5 | Num_rotatable_bonds: | 0 |
| MolWt: | 162.14 | Num_heavy_atoms: | 12 |
| TPSA: | 50.44 | NumAromaticRings: | 2 |
