Glycoside
GD037953
Name:
n-{(2s,3r)-1-[(4-deoxy-alpha-d-xylo-hexopyranosyl)oxy]-3-hydroxyoctadecan-2-yl}hexacosanamideFormula:
C50H99O7NSmiles:
CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@H](CO[C@H]1O[C@H](CO)C[C@H](O)[C@@H]1O)[C@@H](O)CCCCCCCCCCCCCCCAglycone:
CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)CCCCCCCCCCCCCCCSugarmoiety:
OCC1CC(O)C(O)C(O)O1Other Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.98 |
| AlogP: | 12.54 | Num_rotatable_bonds: | 44 |
| MolWt: | 826.34 | Num_heavy_atoms: | 58 |
| TPSA: | 128.48 | NumAromaticRings: | 0 |
Unique Aglycone
AD03985
Formula: C44H89O3N
Smiles:
CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)CCCCCCCCCCCCCCC| HBA: | 4 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.98 |
| AlogP: | 13.69 | Num_rotatable_bonds: | 41 |
| MolWt: | 680.2 | Num_heavy_atoms: | 48 |
| TPSA: | 69.56 | NumAromaticRings: | 0 |
