Glycoside
...
GD157351

Name:
Youngiajaponicoside B

Formula:
C29H36O10

Smiles:
C=C1C(=O)OC2C1CCC(=C)C1CC(OC3OC(CO)C(O)C(OC(=O)Cc4ccc(O)cc4)C3O)C(C)C12

Aglycone:
C=C1C(=O)OC2C1CCC(=C)C1CC(O)C(C)C12.O=C(O)Cc1ccc(O)cc1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 10 RingCount: 5
HBD: 4 FractionCSP3: 0.59
AlogP: 1.39 Num_rotatable_bonds: 6
MolWt: 544.6 Num_heavy_atoms: 39
TPSA: 151.98 NumAromaticRings: 1

Unique Aglycone
AD05358
Formula: C8H8O3

Smiles:
O=C(O)Cc1ccc(O)cc1
HBA: 3 RingCount: 1
HBD: 2 FractionCSP3: 0.12
AlogP: 1.02 Num_rotatable_bonds: 2
MolWt: 152.15 Num_heavy_atoms: 11
TPSA: 57.53 NumAromaticRings: 1
AD62216
Formula: C15H20O3

Smiles:
C=C1C(=O)OC2C1CCC(=C)C1CC(O)C(C)C12
HBA: 3 RingCount: 3
HBD: 1 FractionCSP3: 0.67
AlogP: 2.07 Num_rotatable_bonds: 0
MolWt: 248.32 Num_heavy_atoms: 18
TPSA: 46.53 NumAromaticRings: 0

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O