Glycoside
GD030677
Name:
NoneFormula:
C27H34O12Smiles:
COc1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc2c(c1O)-c1c(cc3c(c1OC)OCO3)[C@H](O)[C@H](C)[C@H](C)C2Aglycone:
COc1c(O)cc2c(c1O)-c1c(cc3c(c1OC)OCO3)C(O)C(C)C(C)C2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.56 |
| AlogP: | 0.85 | Num_rotatable_bonds: | 5 |
| MolWt: | 550.56 | Num_heavy_atoms: | 39 |
| TPSA: | 176.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD19837
Formula: C21H24O7
Smiles:
COc1c(O)cc2c(c1O)-c1c(cc3c(c1OC)OCO3)C(O)C(C)C(C)C2| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.43 |
| AlogP: | 3.37 | Num_rotatable_bonds: | 2 |
| MolWt: | 388.42 | Num_heavy_atoms: | 28 |
| TPSA: | 97.61 | NumAromaticRings: | 2 |
