Glycoside
GD154546
Name:
N-(1-{[3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydroxy-17-methyloctadecan-2-yl)-2-hydroxydocosanamideFormula:
C47H94O9N2Smiles:
CCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(COC1OC(CO)C(O)C(O)C1N)C(O)C(O)CCCCCCCCCCCCC(C)CAglycone:
CCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)C(O)CCCCCCCCCCCCC(C)CSugarmoiety:
NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 9 | FractionCSP3: | 0.98 |
| AlogP: | 8.95 | Num_rotatable_bonds: | 40 |
| MolWt: | 831.27 | Num_heavy_atoms: | 58 |
| TPSA: | 198.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD48310
Formula: C41H83O5N
Smiles:
CCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)C(O)CCCCCCCCCCCCC(C)C| HBA: | 6 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 0.98 |
| AlogP: | 11.16 | Num_rotatable_bonds: | 37 |
| MolWt: | 670.12 | Num_heavy_atoms: | 47 |
| TPSA: | 113.51 | NumAromaticRings: | 0 |
