Glycoside
...
GD004465

Name:
Ciratin

Formula:
C28H34O15

Smiles:
COc1ccc(C2CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](C)C(O)C(O)C5O)C(O)C(O)C4O)cc3O2)cc1O

Aglycone:
COc1ccc(C2CC(=O)c3c(O)cc(O)cc3O2)cc1O

Sugarmoiety:
CC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 15 RingCount: 5
HBD: 8 FractionCSP3: 0.54
AlogP: -1.16 Num_rotatable_bonds: 7
MolWt: 610.57 Num_heavy_atoms: 43
TPSA: 234.29 NumAromaticRings: 2

Unique Aglycone
AD03897
Formula: C16H14O6

Smiles:
COc1ccc(C2CC(=O)c3c(O)cc(O)cc3O2)cc1O
HBA: 6 RingCount: 3
HBD: 3 FractionCSP3: 0.19
AlogP: 2.52 Num_rotatable_bonds: 2
MolWt: 302.28 Num_heavy_atoms: 22
TPSA: 96.22 NumAromaticRings: 2

Sugarmoiety
SD00038

CC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1O