Glycoside
GD001773
Name:
NoneFormula:
C43H80O15Smiles:
CCCCCCCCCCCCCC(=O)OCC(CO[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCCCCCCCCAglycone:
CCCCCCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCCCCCCSugarmoiety:
OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.95 |
| AlogP: | 4.48 | Num_rotatable_bonds: | 34 |
| MolWt: | 837.1 | Num_heavy_atoms: | 58 |
| TPSA: | 231.13 | NumAromaticRings: | 0 |
Unique Aglycone
AD01741
Formula: C31H60O5
Smiles:
CCCCCCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCCCCCC| HBA: | 5 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.94 |
| AlogP: | 8.84 | Num_rotatable_bonds: | 28 |
| MolWt: | 512.82 | Num_heavy_atoms: | 36 |
| TPSA: | 72.83 | NumAromaticRings: | 0 |
