Glycoside
GD118029
Name:
2-hydroxy-N-(3,4,5-trihydroxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}octadec-6-en-2-yl)tetracos-15-enamideFormula:
C48H91O11NSmiles:
CCCCCCCCC=CCCCCCCCCCCCCC(O)C(O)=NC(COC1OC(CO)C(O)C(O)C1O)C(O)C(O)C(O)C=CCCCCCCCCCCCAglycone:
CCCCCCCCC=CCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)C(O)C(O)C=CCCCCCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 1 |
| HBD: | 9 | FractionCSP3: | 0.9 |
| AlogP: | 8.04 | Num_rotatable_bonds: | 40 |
| MolWt: | 858.25 | Num_heavy_atoms: | 60 |
| TPSA: | 212.89 | NumAromaticRings: | 0 |
Unique Aglycone
AD47140
Formula: C42H81O6N
Smiles:
CCCCCCCCC=CCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)C(O)C(O)C=CCCCCCCCCCCC| HBA: | 7 | RingCount: | 0 |
| HBD: | 6 | FractionCSP3: | 0.88 |
| AlogP: | 10.21 | Num_rotatable_bonds: | 37 |
| MolWt: | 696.11 | Num_heavy_atoms: | 49 |
| TPSA: | 133.74 | NumAromaticRings: | 0 |
