Glycoside
...
GD148851

Name:
None

Formula:
C66H106O32

Smiles:
COC1C(O)C(CO)OC(OC2C(O)COC(OC3C(CO)OC(OC4C(OC5CCC6(C)C7=CCC89C(=O)OC(C)(CCCC(C)C)C8C(=O)CC9(C)C7CCC6C5(C)C)OCC(OC5OC(CO)C(O)C(OC6OC(CO)C(O)C(OC)C6O)C5O)C4O)C(O)C3O)C2O)C1O

Aglycone:
CC(C)CCCC1(C)OC(=O)C23CC=C4C(CCC5C4(C)CCC(O)C5(C)C)C2(C)CC(=O)C13

Sugarmoiety:
COC1C(O)C(CO)OC(OC2C(O)COC(OC3C(CO)OC(OC4C(O)OCC(OC5OC(CO)C(O)C(OC6OC(CO)C(O)C(OC)C6O)C5O)C4O)C(O)C3O)C2O)C1O

Other Identifiers

Properties
HBA: 32 RingCount: 11
HBD: 15 FractionCSP3: 0.94
AlogP: -4.22 Num_rotatable_bonds: 22
MolWt: 1411.54 Num_heavy_atoms: 98
TPSA: 476.04 NumAromaticRings: 0

Unique Aglycone
AD05963
Formula: C30H46O4

Smiles:
CC(C)CCCC1(C)OC(=O)C23CC=C4C(CCC5C4(C)CCC(O)C5(C)C)C2(C)CC(=O)C13
HBA: 4 RingCount: 5
HBD: 1 FractionCSP3: 0.87
AlogP: 6.25 Num_rotatable_bonds: 4
MolWt: 470.69 Num_heavy_atoms: 34
TPSA: 63.6 NumAromaticRings: 0

Sugarmoiety
SD07138

COC1C(O)C(CO)OC(OC2C(O)COC(OC3C(CO)OC(OC4C(O)OCC(OC5OC(CO)C(O)C(OC6OC(CO)C(O)C(OC)C6O)C5O)C4O)C(O)C3O)C2O)C1O