Glycoside
GD146125
Name:
Beta-D-Glucosyl-(1<->1')-N-TetracosanoylsphinganineFormula:
C48H95O8NSmiles:
CCCCCCCCCCCCCCCCCCCCCCCC(O)=NC(COC1OC(CO)C(O)C(O)C1O)C(O)CCCCCCCCCCCCCCCAglycone:
CCCCCCCCCCCCCCCCCCCCCCCC(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: | 11.57 | Num_rotatable_bonds: | 42 |
| MolWt: | 814.29 | Num_heavy_atoms: | 57 |
| TPSA: | 152.2 | NumAromaticRings: | 0 |
Unique Aglycone
AD45770
Formula: C42H85O3N
Smiles:
CCCCCCCCCCCCCCCCCCCCCCCC(O)=NC(CO)C(O)CCCCCCCCCCCCCCC| HBA: | 4 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.98 |
| AlogP: | 13.75 | Num_rotatable_bonds: | 39 |
| MolWt: | 652.15 | Num_heavy_atoms: | 46 |
| TPSA: | 73.05 | NumAromaticRings: | 0 |
