Glycoside
GD029521
Name:
NoneFormula:
C17H24O12Smiles:
C[C@]1(O)C[C@H](O)[C@@H]2C(C(=O)O)=CO[C@H](O[C@@H]3O[C@H](COC=O)[C@H](O)[C@H](O)[C@H]3O)[C@H]21Aglycone:
CC1(O)CC(O)C2C(C(=O)O)=COC(O)C21Sugarmoiety:
O=COCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.76 |
| AlogP: | -2.94 | Num_rotatable_bonds: | 6 |
| MolWt: | 420.37 | Num_heavy_atoms: | 29 |
| TPSA: | 192.44 | NumAromaticRings: | 0 |
Unique Aglycone
AD06600
Formula: C10H14O6
Smiles:
CC1(O)CC(O)C2C(C(=O)O)=COC(O)C21| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.7 |
| AlogP: | -0.95 | Num_rotatable_bonds: | 1 |
| MolWt: | 230.22 | Num_heavy_atoms: | 16 |
| TPSA: | 107.22 | NumAromaticRings: | 0 |
