Glycoside
GD031549
Name:
4,5-bis(acetyloxy)-6-{[2-(hexadecyloxy)-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-2-methyloxan-3-yl acetateFormula:
C34H60O13Smiles:
CCCCCCCCCCCCCCCCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](C)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=OAglycone:
CCCCCCCCCCCCCCCCOSugarmoiety:
CC(=O)OC1C(C)OC(OC2C(O)OC(CO)C(O)C2O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.91 |
| AlogP: | 3.85 | Num_rotatable_bonds: | 22 |
| MolWt: | 676.84 | Num_heavy_atoms: | 47 |
| TPSA: | 176.51 | NumAromaticRings: | 0 |
Unique Aglycone
AD01052
Formula: C16H34O
Smiles:
CCCCCCCCCCCCCCCCO| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 5.46 | Num_rotatable_bonds: | 14 |
| MolWt: | 242.45 | Num_heavy_atoms: | 17 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
