Glycoside
GD116091
Name:
Beta-D-Galactosyl-(1<->1')-N-DocosanoylsphinganineFormula:
C46H91O8NSmiles:
CCCCCCCCCCCCCCCCCCCCCC(O)=NC(COC1OC(CO)C(O)C(O)C1O)C(O)CCCCCCCCCCCCCCCAglycone:
CCCCCCCCCCCCCCCCCCCCCC(O)=NC(CO)C(O)CCCCCCCCCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.98 |
| AlogP: | 10.79 | Num_rotatable_bonds: | 40 |
| MolWt: | 786.23 | Num_heavy_atoms: | 55 |
| TPSA: | 152.2 | NumAromaticRings: | 0 |
Unique Aglycone
AD46045
Formula: C40H81O3N
Smiles:
CCCCCCCCCCCCCCCCCCCCCC(O)=NC(CO)C(O)CCCCCCCCCCCCCCC| HBA: | 4 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.97 |
| AlogP: | 12.97 | Num_rotatable_bonds: | 37 |
| MolWt: | 624.09 | Num_heavy_atoms: | 44 |
| TPSA: | 73.05 | NumAromaticRings: | 0 |
