Glycoside

GD148811
Name:
(3,4,5-trihydroxy-6-{[3-methyl-7-methylidene-6-oxo-10-(propan-2-yl)cyclodec-2-en-1-yl]oxy}oxan-2-yl)methyl acetateFormula:
C23H36O8Smiles:
C=C1CCC(C(C)C)C(OC2OC(COC(C)=O)C(O)C(O)C2O)C=C(C)CCC1=OAglycone:
C=C1CCC(C(C)C)C(O)C=C(C)CCC1=O.COC(C)=OSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 8 | RingCount: | 2 |
HBD: | 3 | FractionCSP3: | 0.74 |
AlogP: | 1.66 | Num_rotatable_bonds: | 5 |
MolWt: | 440.53 | Num_heavy_atoms: | 31 |
TPSA: | 122.52 | NumAromaticRings: | 0 |
Unique Aglycone
AD00017
Formula: C3H6O2
Smiles:
COC(C)=OHBA: | 2 | RingCount: | 0 |
HBD: | 0 | FractionCSP3: | 0.67 |
AlogP: | 0.18 | Num_rotatable_bonds: | 0 |
MolWt: | 74.08 | Num_heavy_atoms: | 5 |
TPSA: | 26.3 | NumAromaticRings: | 0 |
AD59529
Formula: C15H24O2
Smiles:
C=C1CCC(C(C)C)C(O)C=C(C)CCC1=OHBA: | 2 | RingCount: | 1 |
HBD: | 1 | FractionCSP3: | 0.67 |
AlogP: | 3.27 | Num_rotatable_bonds: | 1 |
MolWt: | 236.35 | Num_heavy_atoms: | 17 |
TPSA: | 37.3 | NumAromaticRings: | 0 |