Glycoside
GD033697
Name:
NoneFormula:
C23H24O12Smiles:
O=C1O[C@@H]2C=C(COC(=O)c3ccc(O)cc3)[C@@H]3[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)OC=C1[C@@H]23Aglycone:
O=C1OC2C=C(COC(=O)c3ccc(O)cc3)C3C(O)OC=C1C23Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.48 |
| AlogP: | -1.3 | Num_rotatable_bonds: | 6 |
| MolWt: | 492.43 | Num_heavy_atoms: | 35 |
| TPSA: | 181.44 | NumAromaticRings: | 1 |
Unique Aglycone
AD21489
Formula: C17H14O7
Smiles:
O=C1OC2C=C(COC(=O)c3ccc(O)cc3)C3C(O)OC=C1C23| HBA: | 7 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 0.88 | Num_rotatable_bonds: | 3 |
| MolWt: | 330.29 | Num_heavy_atoms: | 24 |
| TPSA: | 102.29 | NumAromaticRings: | 1 |
