Glycoside
...
GD118860

Name:
Cynascyroside E

Formula:
C46H70O18

Smiles:
COC1CC(OC2C(O)CC(OC3CC4=CCC5C(=O)C(c6ccoc6C)CCC5C4(C)CC3O)OC2C)OC(C)C1OC1CC(OC)C(OC2OC(CO)C(O)C(O)C2O)C(C)O1

Aglycone:
Cc1occc1C1CCC2C(CC=C3CC(O)C(O)CC32C)C1=O

Sugarmoiety:
COC1CC(OC2C(O)CC(O)OC2C)OC(C)C1OC1CC(OC)C(OC2OC(CO)C(O)C(O)C2O)C(C)O1

Other Identifiers

Properties
HBA: 18 RingCount: 8
HBD: 6 FractionCSP3: 0.85
AlogP: 1.89 Num_rotatable_bonds: 12
MolWt: 911.05 Num_heavy_atoms: 64
TPSA: 243.89 NumAromaticRings: 1

Unique Aglycone
AD46211
Formula: C20H26O4

Smiles:
Cc1occc1C1CCC2C(CC=C3CC(O)C(O)CC32C)C1=O
HBA: 4 RingCount: 4
HBD: 2 FractionCSP3: 0.65
AlogP: 3.12 Num_rotatable_bonds: 1
MolWt: 330.42 Num_heavy_atoms: 24
TPSA: 70.67 NumAromaticRings: 1

Sugarmoiety
SD02836

COC1CC(OC2C(O)CC(O)OC2C)OC(C)C1OC1CC(OC)C(OC2OC(CO)C(O)C(O)C2O)C(C)O1