Glycoside
GD015412
Name:
NoneFormula:
C47H78O10Smiles:
CCCCCCCCC=CCCCCCCCC(=O)O[C@H](COC(=O)C=CC=CC=CC=CC=CCCCCCCCCC)CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
CCCCCCCCC=CCCCCCCCC(=O)OC(CO)COC(=O)C=CC=CC=CC=CC=CCCCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.7 |
| AlogP: | 9.22 | Num_rotatable_bonds: | 35 |
| MolWt: | 803.13 | Num_heavy_atoms: | 57 |
| TPSA: | 151.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD11201
Formula: C41H68O5
Smiles:
CCCCCCCCC=CCCCCCCCC(=O)OC(CO)COC(=O)C=CC=CC=CC=CC=CCCCCCCCCC| HBA: | 5 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.66 |
| AlogP: | 11.39 | Num_rotatable_bonds: | 32 |
| MolWt: | 640.99 | Num_heavy_atoms: | 46 |
| TPSA: | 72.83 | NumAromaticRings: | 0 |
