Glycoside
...
GD134229

Name:
None

Formula:
C62H96O28

Smiles:
C=C(C)CCC(OC(C)=O)C1(C)OC(=O)C23CC=C4C(CCC5C4(C)CCC(OC4OCC(OC6OCC(O)C(O)C6O)C(O)C4OC4OC(C)C(OC6OCC(O)C(OC7OC(CO)C(O)C(OC)C7O)C6O)C(O)C4O)C5(C)C)C2(C)CC(OC(C)=O)C13

Aglycone:
C=C(C)CCC(OC(C)=O)C1(C)OC(=O)C23CC=C4C(CCC5C4(C)CCC(O)C5(C)C)C2(C)CC(OC(C)=O)C13

Sugarmoiety:
COC1C(O)C(CO)OC(OC2C(O)COC(OC3C(C)OC(OC4C(O)OCC(OC5OCC(O)C(O)C5O)C4O)C(O)C3O)C2O)C1O

Other Identifiers

Properties
HBA: 28 RingCount: 10
HBD: 11 FractionCSP3: 0.89
AlogP: -1.2 Num_rotatable_bonds: 18
MolWt: 1289.42 Num_heavy_atoms: 90
TPSA: 402.96 NumAromaticRings: 0

Unique Aglycone
AD45924
Formula: C34H50O7

Smiles:
C=C(C)CCC(OC(C)=O)C1(C)OC(=O)C23CC=C4C(CCC5C4(C)CCC(O)C5(C)C)C2(C)CC(OC(C)=O)C13
HBA: 7 RingCount: 5
HBD: 1 FractionCSP3: 0.79
AlogP: 6.08 Num_rotatable_bonds: 6
MolWt: 570.77 Num_heavy_atoms: 41
TPSA: 99.13 NumAromaticRings: 0

Sugarmoiety
SD07774

COC1C(O)C(CO)OC(OC2C(O)COC(OC3C(C)OC(OC4C(O)OCC(OC5OCC(O)C(O)C5O)C4O)C(O)C3O)C2O)C1O