Glycoside
...
GD147261

Name:
Ixerin O

Formula:
C34H42O13

Smiles:
C=C1CC(OC(=O)C(O)C(C)C)C2C(=C)C(=O)OC2C2C(=C)C(OC3OC(CO)C(OC(=O)Cc4ccc(O)cc4)C(O)C3O)CC12

Aglycone:
C=C1CC(OC(=O)C(O)C(C)C)C2C(=C)C(=O)OC2C2C(=C)C(O)CC12.O=C(O)Cc1ccc(O)cc1

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

Other Identifiers

Properties
HBA: 13 RingCount: 5
HBD: 5 FractionCSP3: 0.56
AlogP: 0.85 Num_rotatable_bonds: 9
MolWt: 658.7 Num_heavy_atoms: 47
TPSA: 198.51 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
AD07772
Formula: C20H26O6

Smiles:
C=C1CC(OC(=O)C(O)C(C)C)C2C(=C)C(=O)OC2C2C(=C)C(O)CC12
HBA: 6 RingCount: 3
HBD: 2 FractionCSP3: 0.6
AlogP: 1.53 Num_rotatable_bonds: 3
MolWt: 362.42 Num_heavy_atoms: 26
TPSA: 93.06 NumAromaticRings: 0

Sugarmoiety
SD00003

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