Glycoside
...
GD123732

Name:
4-[(6-carboxy-3,4,5-trihydroxyoxan-2-yl)oxy]-3-{[3-({6-carboxy-4-[(6-carboxy-3,4,5-trihydroxyoxan-2-yl)oxy]-3,5-dihydroxyoxan-2-yl}oxy)-4,5-dihydroxy-6-methyloxan-2-yl]oxy}-5-hydroxy-6-[(2,4,5-trihydroxy-6-methyloxan-3-yl)oxy]oxane-2-carboxylic acid

Formula:
C36H54O33

Smiles:
CC1OC(O)C(OC2OC(C(=O)O)C(OC3OC(C)C(O)C(O)C3OC3OC(C(=O)O)C(O)C(OC4OC(C(=O)O)C(O)C(O)C4O)C3O)C(OC3OC(C(=O)O)C(O)C(O)C3O)C2O)C(O)C1O

Aglycone:
[empty]

Sugarmoiety:
CC1OC(O)C(OC2OC(C(=O)O)C(OC3OC(C)C(O)C(O)C3OC3OC(C(=O)O)C(O)C(OC4OC(C(=O)O)C(O)C(O)C4O)C3O)C(OC3OC(C(=O)O)C(O)C(O)C3O)C2O)C(O)C1O

Other Identifiers

Properties
HBA: 33 RingCount: 6
HBD: 18 FractionCSP3: 0.89
AlogP: -11.68 Num_rotatable_bonds: 14
MolWt: 1014.8 Num_heavy_atoms: 69
TPSA: 533.95 NumAromaticRings: 0

Unique Aglycone

Sugarmoiety
SD06191

CC1OC(O)C(OC2OC(C(=O)O)C(OC3OC(C)C(O)C(O)C3OC3OC(C(=O)O)C(O)C(OC4OC(C(=O)O)C(O)C(O)C4O)C3O)C(OC3OC(C(=O)O)C(O)C(O)C3O)C2O)C(O)C1O