Glycoside
GD030229
Name:
NoneFormula:
C21H26O9Smiles:
CC=CC=C[C@@H]1Cc2cc(O[C@@H]3O[C@H](CO)[C@H](OC)[C@H](O)[C@H]3O)cc(O)c2C(=O)O1Aglycone:
CC=CC=CC1Cc2cc(O)cc(O)c2C(=O)O1Sugarmoiety:
COC1C(CO)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.48 |
| AlogP: | 0.44 | Num_rotatable_bonds: | 6 |
| MolWt: | 422.43 | Num_heavy_atoms: | 30 |
| TPSA: | 134.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD19572
Formula: C14H14O4
Smiles:
CC=CC=CC1Cc2cc(O)cc(O)c2C(=O)O1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.21 |
| AlogP: | 2.31 | Num_rotatable_bonds: | 2 |
| MolWt: | 246.26 | Num_heavy_atoms: | 18 |
| TPSA: | 66.76 | NumAromaticRings: | 1 |
