Glycoside
GD017652
Name:
NoneFormula:
C25H26O12Smiles:
CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](OC(=O)C=Cc2ccc(O)c(O)c2)[C@H]1OC(=O)C=Cc1ccc(O)c(O)c1Aglycone:
O=C(O)C=Cc1ccc(O)c(O)c1.O=C(O)C=Cc1ccc(O)c(O)c1Sugarmoiety:
COC1OC(CO)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.28 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 8 |
| MolWt: | 518.47 | Num_heavy_atoms: | 37 |
| TPSA: | 192.44 | NumAromaticRings: | 2 |
Unique Aglycone
AD00127
Formula: C9H8O4
Smiles:
O=C(O)C=Cc1ccc(O)c(O)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 2 |
| MolWt: | 180.16 | Num_heavy_atoms: | 13 |
| TPSA: | 77.76 | NumAromaticRings: | 1 |
