Glycoside
...
GD157100

Name:
N-{5-[(5-{[6-({[3,5-dihydroxy-6-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}methyl)-5-hydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-2-yl]oxy}-3-acetamido-4-hydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl}acetamide

Formula:
C45H76O35N2

Smiles:
CC(O)=NC1C(O)OC(CO)C(OC2OC(CO)C(OC3OC(COC4OC(CO)C(O)C(OC5OC(CO)C(O)C(O)C5O)C4O)C(O)C(OC4OC(CO)C(O)C(O)C4O)C3OC3OCC(O)C(O)C3O)C(O)C2N=C(C)O)C1O

Aglycone:
[empty]

Sugarmoiety:
CC(O)=NC1C(O)OC(CO)C(OC2OC(CO)C(OC3OC(COC4OC(CO)C(O)C(OC5OC(CO)C(O)C(O)C5O)C4O)C(O)C(OC4OC(CO)C(O)C(O)C4O)C3OC3OCC(O)C(O)C3O)C(O)C2N=C(C)O)C1O

Other Identifiers

Properties
HBA: 37 RingCount: 7
HBD: 22 FractionCSP3: 0.96
AlogP: -13.67 Num_rotatable_bonds: 20
MolWt: 1205.08 Num_heavy_atoms: 82
TPSA: 589.77 NumAromaticRings: 0

Unique Aglycone

Sugarmoiety
SD10539

CC(O)=NC1C(O)OC(CO)C(OC2OC(CO)C(OC3OC(COC4OC(CO)C(O)C(OC5OC(CO)C(O)C(O)C5O)C4O)C(O)C(OC4OC(CO)C(O)C(O)C4O)C3OC3OCC(O)C(O)C3O)C(O)C2N=C(C)O)C1O