Glycoside
GD125982
Name:
5-hexyl-3-methoxy-2-methyl-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1,4,5,6,7,8-hexahydroquinolin-4-oneFormula:
C23H37O8NSmiles:
CCCCCCC1CCC(OC2OC(CO)C(O)C(O)C2O)c2[nH]c(C)c(OC)c(=O)c21Aglycone:
CCCCCCC1CCC(O)c2[nH]c(C)c(OC)c(=O)c21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.78 |
| AlogP: | 1.4 | Num_rotatable_bonds: | 9 |
| MolWt: | 455.55 | Num_heavy_atoms: | 32 |
| TPSA: | 141.47 | NumAromaticRings: | 1 |
Unique Aglycone
AD50958
Formula: C17H27O3N
Smiles:
CCCCCCC1CCC(O)c2[nH]c(C)c(OC)c(=O)c21| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.71 |
| AlogP: | 3.57 | Num_rotatable_bonds: | 6 |
| MolWt: | 293.41 | Num_heavy_atoms: | 21 |
| TPSA: | 62.32 | NumAromaticRings: | 1 |
