Glycoside
GD143201
Name:
5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl 3,4,5,6-tetrahydroxyoxane-2-carboxylateFormula:
C21H18O10Smiles:
O=C(Oc1cc(O)c2c(=O)cc(-c3ccccc3)oc2c1)C1OC(O)C(O)C(O)C1OAglycone:
O=COc1cc(O)c2c(=O)cc(-c3ccccc3)oc2c1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.24 |
| AlogP: | -0.13 | Num_rotatable_bonds: | 3 |
| MolWt: | 430.37 | Num_heavy_atoms: | 31 |
| TPSA: | 166.89 | NumAromaticRings: | 3 |
Unique Aglycone
AD57602
Formula: C16H10O5
Smiles:
O=COc1cc(O)c2c(=O)cc(-c3ccccc3)oc2c1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.7 | Num_rotatable_bonds: | 3 |
| MolWt: | 282.25 | Num_heavy_atoms: | 21 |
| TPSA: | 76.74 | NumAromaticRings: | 3 |
