Glycoside
...
GD121132

Name:
2-({2-[(2-{[4-({4-[(4-{[3,5-dihydroxy-4-methoxy-6-(methoxymethyl)oxan-2-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl}oxy)-3,5-dihydroxy-6-methyloxan-2-yl]methoxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl)oxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triol

Formula:
C45H78O35

Smiles:
COCC1OC(OC2C(O)C(CO)OC(OC3C(O)C(CO)OC(OC4C(O)C(C)OC(COC5OC(CO)C(O)C(OC6OC(CO)C(O)C(OC7OC(CO)C(O)C(O)C7O)C6O)C5O)C4O)C3O)C2O)C(O)C(OC)C1O

Aglycone:
[empty]

Sugarmoiety:
COCC1OC(OC2C(O)C(CO)OC(OC3C(O)C(CO)OC(OC4C(O)C(C)OC(COC5OC(CO)C(O)C(OC6OC(CO)C(O)C(OC7OC(CO)C(O)C(O)C7O)C6O)C5O)C4O)C3O)C2O)C(O)C(OC)C1O

Other Identifiers

Properties
HBA: 35 RingCount: 7
HBD: 20 FractionCSP3: 1.0
AlogP: -13.9 Num_rotatable_bonds: 21
MolWt: 1179.08 Num_heavy_atoms: 80
TPSA: 543.05 NumAromaticRings: 0

Unique Aglycone

Sugarmoiety
SD05758

COCC1OC(OC2C(O)C(CO)OC(OC3C(O)C(CO)OC(OC4C(O)C(C)OC(COC5OC(CO)C(O)C(OC6OC(CO)C(O)C(OC7OC(CO)C(O)C(O)C7O)C6O)C5O)C4O)C3O)C2O)C(O)C(OC)C1O