Glycoside
GD010354
Name:
NoneFormula:
C45H74O10Smiles:
CCCCCCCCCC=CC=CC=CC=CC=CC=CC(=O)O[C@H](COC(=O)CCCCCCCCCCCCC)CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
CCCCCCCCCC=CC=CC=CC=CC=CC=CC(=O)OC(CO)COC(=O)CCCCCCCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.69 |
| AlogP: | 8.44 | Num_rotatable_bonds: | 33 |
| MolWt: | 775.08 | Num_heavy_atoms: | 55 |
| TPSA: | 151.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD08010
Formula: C39H64O5
Smiles:
CCCCCCCCCC=CC=CC=CC=CC=CC=CC(=O)OC(CO)COC(=O)CCCCCCCCCCCCC| HBA: | 5 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.64 |
| AlogP: | 10.61 | Num_rotatable_bonds: | 30 |
| MolWt: | 612.94 | Num_heavy_atoms: | 44 |
| TPSA: | 72.83 | NumAromaticRings: | 0 |
