Glycoside
GD034677
Name:
NoneFormula:
C23H20O12Smiles:
COc1c2c(cc3occ(-c4ccc(O[C@@H]5O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]5O)cc4)c(=O)c13)OCO2Aglycone:
COc1c2c(cc3occ(-c4ccc(O)cc4)c(=O)c13)OCO2Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.3 |
| AlogP: | 0.47 | Num_rotatable_bonds: | 5 |
| MolWt: | 488.4 | Num_heavy_atoms: | 35 |
| TPSA: | 174.35 | NumAromaticRings: | 3 |
Unique Aglycone
AD22013
Formula: C17H12O6
Smiles:
COc1c2c(cc3occ(-c4ccc(O)cc4)c(=O)c13)OCO2| HBA: | 6 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 2.9 | Num_rotatable_bonds: | 2 |
| MolWt: | 312.28 | Num_heavy_atoms: | 23 |
| TPSA: | 78.13 | NumAromaticRings: | 3 |
