Glycoside
GD157031
Name:
7-hydroxy-3-[(2-oxo-2H-chromen-7-yl)oxy]-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H-chromen-2-oneFormula:
C24H20O12Smiles:
O=c1ccc2ccc(Oc3cc4cc(OC5OC(CO)C(O)C(O)C5O)c(O)cc4oc3=O)cc2o1Aglycone:
O=c1ccc2ccc(Oc3cc4cc(O)c(O)cc4oc3=O)cc2o1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.25 |
| AlogP: | 0.58 | Num_rotatable_bonds: | 5 |
| MolWt: | 500.41 | Num_heavy_atoms: | 36 |
| TPSA: | 189.26 | NumAromaticRings: | 4 |
Unique Aglycone
AD50349
Formula: C18H10O7
Smiles:
O=c1ccc2ccc(Oc3cc4cc(O)c(O)cc4oc3=O)cc2o1| HBA: | 7 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 3.1 | Num_rotatable_bonds: | 2 |
| MolWt: | 338.27 | Num_heavy_atoms: | 25 |
| TPSA: | 110.11 | NumAromaticRings: | 4 |
