Glycoside
...
GD119737

Name:
5-[(6-{[(3-{[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}-4,5-dihydroxyoxan-2-yl)oxy]methyl}-5-[(6-{[(3-{[3,4-dihydroxy-6-(hydroxymethyl)-5-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]oxan-2-yl]oxy}-4,5-dihydroxyoxan-2-yl)oxy]methyl}-3,4,5-trihydroxyoxan-2-yl)oxy]-3,4-dihydroxyoxan-2-yl)oxy]-6-(hydroxymethyl)oxane-2,3,4-triol

Formula:
C57H96O47

Smiles:
CC1OC(OC2C(OC3C(OCC4OC(OC5C(CO)OC(O)C(O)C5O)C(O)C(O)C4OC4OC(COC5OCC(O)C(O)C5OC5OC(CO)C(OC6OC(COC7OCC(O)C(O)C7O)C(O)C(O)C6O)C(O)C5O)C(O)C(O)C4O)OCC(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O

Aglycone:
[empty]

Sugarmoiety:
CC1OC(OC2C(OC3C(OCC4OC(OC5C(CO)OC(O)C(O)C5O)C(O)C(O)C4OC4OC(COC5OCC(O)C(O)C5OC5OC(CO)C(OC6OC(COC7OCC(O)C(O)C7O)C(O)C(O)C6O)C(O)C5O)C(O)C(O)C4O)OCC(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 47 RingCount: 10
HBD: 28 FractionCSP3: 1.0
AlogP: -19.86 Num_rotatable_bonds: 24
MolWt: 1533.35 Num_heavy_atoms: 104
TPSA: 741.81 NumAromaticRings: 0

Unique Aglycone

Sugarmoiety
SD05494

CC1OC(OC2C(OC3C(OCC4OC(OC5C(CO)OC(O)C(O)C5O)C(O)C(O)C4OC4OC(COC5OCC(O)C(O)C5OC5OC(CO)C(OC6OC(COC7OCC(O)C(O)C7O)C(O)C(O)C6O)C(O)C5O)C(O)C(O)C4O)OCC(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O