Glycoside
GD013677
Name:
NoneFormula:
C49H74O10Smiles:
CCCCCCCCCC=CC=CC=CC=CC=CC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)C=CC=CC=CC=CC=CCCCCCCCCCAglycone:
CCCCCCCCCC=CC=CC=CC=CC=CC(=O)OCC(CO)OC(=O)C=CC=CC=CC=CC=CCCCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.55 |
| AlogP: | 9.1 | Num_rotatable_bonds: | 33 |
| MolWt: | 823.12 | Num_heavy_atoms: | 59 |
| TPSA: | 151.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD10165
Formula: C43H64O5
Smiles:
CCCCCCCCCC=CC=CC=CC=CC=CC(=O)OCC(CO)OC(=O)C=CC=CC=CC=CC=CCCCCCCCCC| HBA: | 5 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.49 |
| AlogP: | 11.28 | Num_rotatable_bonds: | 30 |
| MolWt: | 660.98 | Num_heavy_atoms: | 48 |
| TPSA: | 72.83 | NumAromaticRings: | 0 |
