Glycoside
GD135680
Name:
2,4,6,4'-Tetrahydroxy-2-Benzylcoumaranone 6-Beta-D-GlucopyranosideFormula:
C21H22O11Smiles:
O=C1c2c(O)cc(OC3OC(CO)C(O)C(O)C3O)cc2OC1(O)Cc1ccc(O)cc1Aglycone:
O=C1c2c(O)cc(O)cc2OC1(O)Cc1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.38 |
| AlogP: | -1.22 | Num_rotatable_bonds: | 5 |
| MolWt: | 450.4 | Num_heavy_atoms: | 32 |
| TPSA: | 186.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD21834
Formula: C15H12O6
Smiles:
O=C1c2c(O)cc(O)cc2OC1(O)Cc1ccc(O)cc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.13 |
| AlogP: | 1.31 | Num_rotatable_bonds: | 2 |
| MolWt: | 288.25 | Num_heavy_atoms: | 21 |
| TPSA: | 107.22 | NumAromaticRings: | 2 |
