Glycoside
...
GD147719

Name:
Cynascyroside B

Formula:
C47H72O18

Smiles:
COC1CC(OC2CC3=CCC4C(=O)C(c5ccoc5C)CCC4C3(C)CC2O)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3OC(CO)C(O)C(O)C3O)C(C)O2)C(C)O1

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

Sugarmoiety:
COC1CC(O)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3OC(CO)C(O)C(O)C3O)C(C)O2)C(C)O1

Other Identifiers

Properties
HBA: 18 RingCount: 8
HBD: 5 FractionCSP3: 0.85
AlogP: 2.55 Num_rotatable_bonds: 13
MolWt: 925.08 Num_heavy_atoms: 65
TPSA: 232.89 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
SD02036

COC1CC(O)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3OC(CO)C(O)C(O)C3O)C(C)O2)C(C)O1