Glycoside
...
GD155363

Name:
N-(2-{[3,5-dihydroxy-2-(hydroxymethyl)-6-[(1,2,4,5-tetrahydroxy-6-oxohexan-3-yl)oxy]oxan-4-yl]oxy}-4-[(4-{[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5-hydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl)oxy]-6-(hydroxymethyl)-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-3-yl)acetamide

Formula:
C46H78O34N2

Smiles:
CC(O)=NC1C(OC2C(O)C(CO)OC(OC3C(N=C(C)O)C(OC4C(O)C(CO)OC(OC(C(O)CO)C(O)C(O)C=O)C4O)OC(CO)C3OC3OC(C)C(O)C(O)C3O)C2OC2OC(C)C(O)C(O)C2O)OC(CO)C(O)C1O

Aglycone:
[empty]

Sugarmoiety:
CC(O)=NC1C(OC2C(O)C(CO)OC(OC3C(N=C(C)O)C(OC4C(O)C(CO)OC(OC(C(O)CO)C(O)C(O)C=O)C4O)OC(CO)C3OC3OC(C)C(O)C(O)C3O)C2OC2OC(C)C(O)C(O)C2O)OC(CO)C(O)C1O

Other Identifiers

Properties
HBA: 36 RingCount: 6
HBD: 21 FractionCSP3: 0.93
AlogP: -12.41 Num_rotatable_bonds: 23
MolWt: 1203.11 Num_heavy_atoms: 82
TPSA: 577.38 NumAromaticRings: 0

Unique Aglycone

Sugarmoiety
SD10339

CC(O)=NC1C(OC2C(O)C(CO)OC(OC3C(N=C(C)O)C(OC4C(O)C(CO)OC(OC(C(O)CO)C(O)C(O)C=O)C4O)OC(CO)C3OC3OC(C)C(O)C(O)C3O)C2OC2OC(C)C(O)C(O)C2O)OC(CO)C(O)C1O