Glycoside

GD144604
Name:
Nerolidol GlycosideFormula:
C39H66O18Smiles:
C=CC(C)(CCC=C(C)CCC=C(C)C)OC1OC(COC2OC(C)C(O)C(O)C2O)C(O)C(O)C1OC1OC(C)C(OC2OC(C)C(O)C(O)C2O)C(O)C1OAglycone:
C=CC(C)(O)CCC=C(C)CCC=C(C)CSugarmoiety:
CC1OC(OCC2OC(O)C(OC3OC(C)C(OC4OC(C)C(O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 18 | RingCount: | 4 |
HBD: | 10 | FractionCSP3: | 0.85 |
AlogP: | -1.22 | Num_rotatable_bonds: | 16 |
MolWt: | 822.94 | Num_heavy_atoms: | 57 |
TPSA: | 276.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD45694
Formula: C15H26O
Smiles:
C=CC(C)(O)CCC=C(C)CCC=C(C)CHBA: | 1 | RingCount: | 0 |
HBD: | 1 | FractionCSP3: | 0.6 |
AlogP: | 4.4 | Num_rotatable_bonds: | 7 |
MolWt: | 222.37 | Num_heavy_atoms: | 16 |
TPSA: | 20.23 | NumAromaticRings: | 0 |