Glycoside
GD124939
Name:
N-(3,5-dihydroxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}octadecan-2-yl)-2-hydroxynonadecanamideFormula:
C43H85O10NSmiles:
CCCCCCCCCCCCCCCCCC(O)C(O)=NC(COC1OC(CO)C(O)C(O)C1O)C(O)CC(O)CCCCCCCCCCCCCAglycone:
CCCCCCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)CC(O)CCCCCCCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 8 | FractionCSP3: | 0.98 |
| AlogP: | 7.56 | Num_rotatable_bonds: | 37 |
| MolWt: | 776.15 | Num_heavy_atoms: | 54 |
| TPSA: | 192.66 | NumAromaticRings: | 0 |
Unique Aglycone
AD50514
Formula: C37H75O5N
Smiles:
CCCCCCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)CC(O)CCCCCCCCCCCCC| HBA: | 6 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 0.97 |
| AlogP: | 9.74 | Num_rotatable_bonds: | 34 |
| MolWt: | 614.01 | Num_heavy_atoms: | 43 |
| TPSA: | 113.51 | NumAromaticRings: | 0 |
