Glycoside
GD129591
Name:
N-(1-{[3,4-dihydroxy-6-(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3-hydroxyoctadec-4-en-2-yl)formamideFormula:
C31H57O13NSmiles:
CCCCCCCCCCCCCC=CC(O)C(COC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1O)N=COAglycone:
CCCCCCCCCCCCCC=CC(O)C(CO)N=COSugarmoiety:
OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 2 |
| HBD: | 9 | FractionCSP3: | 0.9 |
| AlogP: | 0.2 | Num_rotatable_bonds: | 22 |
| MolWt: | 651.79 | Num_heavy_atoms: | 45 |
| TPSA: | 231.35 | NumAromaticRings: | 0 |
Unique Aglycone
AD52497
Formula: C19H37O3N
Smiles:
CCCCCCCCCCCCCC=CC(O)C(CO)N=CO| HBA: | 4 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.84 |
| AlogP: | 4.55 | Num_rotatable_bonds: | 16 |
| MolWt: | 327.51 | Num_heavy_atoms: | 23 |
| TPSA: | 73.05 | NumAromaticRings: | 0 |
