Glycoside
...
GD012949

Name:
ERYCIBOSIDE H

Formula:
C28H36O15

Smiles:
COc1cc(C(=O)OC[C@]2(O)CO[C@H](OC[C@@H]3O[C@H](OCCc4ccc(O)cc4)[C@H](O)[C@H](O)[C@H]3O)[C@H]2O)cc(OC)c1O

Aglycone:
COC(=O)c1cc(OC)c(O)c(OC)c1.OCCc1ccc(O)cc1

Sugarmoiety:
OC1OC(COC2OCC(O)(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 15 RingCount: 4
HBD: 7 FractionCSP3: 0.54
AlogP: -1.2 Num_rotatable_bonds: 12
MolWt: 612.58 Num_heavy_atoms: 43
TPSA: 223.29 NumAromaticRings: 2

Unique Aglycone
AD00094
Formula: C10H12O5

Smiles:
COC(=O)c1cc(OC)c(O)c(OC)c1
HBA: 5 RingCount: 1
HBD: 1 FractionCSP3: 0.3
AlogP: 1.2 Num_rotatable_bonds: 3
MolWt: 212.2 Num_heavy_atoms: 15
TPSA: 64.99 NumAromaticRings: 1
AD03863
Formula: C8H10O2

Smiles:
OCCc1ccc(O)cc1
HBA: 2 RingCount: 1
HBD: 2 FractionCSP3: 0.25
AlogP: 0.93 Num_rotatable_bonds: 2
MolWt: 138.17 Num_heavy_atoms: 10
TPSA: 40.46 NumAromaticRings: 1

Sugarmoiety
SD00940

OC1OC(COC2OCC(O)(O)C2O)C(O)C(O)C1O