Glycoside
...
GD154216

Name:
Stauntoside B

Formula:
C40H58O15

Smiles:
COC1CC(OC2C(O)CC(OC3C(O)CC(OC4CCC5(C)C(=CCC6C(=O)OC7COC8(C)OC(=O)C(=CCC65)C78)C4)OC3C)OC2C)OC(C)C1O

Aglycone:
CC12OCC3OC(=O)C4CC=C5CC(O)CCC5(C)C4CC=C(C(=O)O1)C32

Sugarmoiety:
COC1CC(OC2C(O)CC(OC3C(O)CC(O)OC3C)OC2C)OC(C)C1O

Other Identifiers

Properties
HBA: 15 RingCount: 8
HBD: 3 FractionCSP3: 0.85
AlogP: 2.56 Num_rotatable_bonds: 7
MolWt: 778.89 Num_heavy_atoms: 55
TPSA: 187.13 NumAromaticRings: 0

Unique Aglycone
AD02276
Formula: C21H26O6

Smiles:
CC12OCC3OC(=O)C4CC=C5CC(O)CCC5(C)C4CC=C(C(=O)O1)C32
HBA: 6 RingCount: 5
HBD: 1 FractionCSP3: 0.71
AlogP: 2.26 Num_rotatable_bonds: 0
MolWt: 374.43 Num_heavy_atoms: 27
TPSA: 82.06 NumAromaticRings: 0

Sugarmoiety
SD04647

COC1CC(OC2C(O)CC(OC3C(O)CC(O)OC3C)OC2C)OC(C)C1O