Glycoside
GD119772
Name:
N-(3,4-dihydroxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}tetracosan-2-yl)-2-hydroxyoctadec-4-enamideFormula:
C48H93O10NSmiles:
CCCCCCCCCCCCCC=CCC(O)C(O)=NC(COC1OC(CO)C(O)C(O)C1O)C(O)C(O)CCCCCCCCCCCCCCCCCCCCAglycone:
CCCCCCCCCCCCCC=CCC(O)C(O)=NC(CO)C(O)C(O)CCCCCCCCCCCCCCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 8 | FractionCSP3: | 0.94 |
| AlogP: | 9.29 | Num_rotatable_bonds: | 41 |
| MolWt: | 844.27 | Num_heavy_atoms: | 59 |
| TPSA: | 192.66 | NumAromaticRings: | 0 |
Unique Aglycone
AD48047
Formula: C42H83O5N
Smiles:
CCCCCCCCCCCCCC=CCC(O)C(O)=NC(CO)C(O)C(O)CCCCCCCCCCCCCCCCCCCC| HBA: | 6 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 0.93 |
| AlogP: | 11.47 | Num_rotatable_bonds: | 38 |
| MolWt: | 682.13 | Num_heavy_atoms: | 48 |
| TPSA: | 113.51 | NumAromaticRings: | 0 |
