Glycoside

GD134830
Name:
2-({10-butyl-9-hydroxy-2,8-dimethyltricyclo[4.4.0.0²,â¸]dec-4-en-7-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C22H36O7Smiles:
CCCCC1C2C3C=CCC2(C)C(C)(C1O)C3OC1OC(CO)C(O)C(O)C1OAglycone:
CCCCC1C2C3C=CCC2(C)C(C)(C3O)C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 7 | RingCount: | 4 |
HBD: | 5 | FractionCSP3: | 0.91 |
AlogP: | 0.57 | Num_rotatable_bonds: | 6 |
MolWt: | 412.52 | Num_heavy_atoms: | 29 |
TPSA: | 119.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD54538
Formula: C16H26O2
Smiles:
CCCCC1C2C3C=CCC2(C)C(C)(C3O)C1OHBA: | 2 | RingCount: | 3 |
HBD: | 2 | FractionCSP3: | 0.88 |
AlogP: | 2.75 | Num_rotatable_bonds: | 3 |
MolWt: | 250.38 | Num_heavy_atoms: | 18 |
TPSA: | 40.46 | NumAromaticRings: | 0 |