Glycoside
GD017173
Name:
NoneFormula:
C26H28O17Smiles:
O=c1c(O)c(-c2ccc(O)cc2)oc2c(OC3OC[C@H](O)[C@H](O)[C@H]3O)c(O)c(OC3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(O)c12Aglycone:
O=c1c(O)c(-c2ccc(O)cc2)oc2c(O)c(O)c(O)c(O)c12Sugarmoiety:
OC1COC(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 5 |
| HBD: | 11 | FractionCSP3: | 0.42 |
| AlogP: | -2.72 | Num_rotatable_bonds: | 6 |
| MolWt: | 612.49 | Num_heavy_atoms: | 43 |
| TPSA: | 289.66 | NumAromaticRings: | 3 |
Unique Aglycone
AD00204
Formula: C15H10O8
Smiles:
O=c1c(O)c(-c2ccc(O)cc2)oc2c(O)c(O)c(O)c(O)c12| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.0 |
| AlogP: | 1.69 | Num_rotatable_bonds: | 1 |
| MolWt: | 318.24 | Num_heavy_atoms: | 23 |
| TPSA: | 151.59 | NumAromaticRings: | 3 |
