Glycoside
GD100071
Name:
NoneFormula:
C21H24O12Smiles:
COC(=O)[C@H]1O[C@@H](Oc2ccc(C=O)cc2OC)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=OAglycone:
COc1cc(C=O)ccc1OSugarmoiety:
COC(=O)C1OC(O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.48 |
| AlogP: | 0.58 | Num_rotatable_bonds: | 8 |
| MolWt: | 468.41 | Num_heavy_atoms: | 33 |
| TPSA: | 149.96 | NumAromaticRings: | 1 |
Unique Aglycone
AD21340
Formula: C8H8O3
Smiles:
COc1cc(C=O)ccc1O| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 1.21 | Num_rotatable_bonds: | 2 |
| MolWt: | 152.15 | Num_heavy_atoms: | 11 |
| TPSA: | 46.53 | NumAromaticRings: | 1 |
