Glycoside
GD115900
Name:
5,7-dihydroxy-2-(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-4H-chromen-4-oneFormula:
C21H20O10Smiles:
O=c1cc(-c2ccccc2OC2OC(CO)C(O)C(O)C2O)oc2cc(O)cc(O)c12Aglycone:
O=c1cc(-c2ccccc2O)oc2cc(O)cc(O)c12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.29 |
| AlogP: | 0.05 | Num_rotatable_bonds: | 4 |
| MolWt: | 432.38 | Num_heavy_atoms: | 31 |
| TPSA: | 170.05 | NumAromaticRings: | 3 |
Unique Aglycone
AD09389
Formula: C15H10O5
Smiles:
O=c1cc(-c2ccccc2O)oc2cc(O)cc(O)c12| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 2.58 | Num_rotatable_bonds: | 1 |
| MolWt: | 270.24 | Num_heavy_atoms: | 20 |
| TPSA: | 90.9 | NumAromaticRings: | 3 |
