Glycoside
...
GD146133

Name:
2-amino-6-({3-carboxy-1-[(1-carboxy-2-hydroxyethyl)-C-hydroxycarbonimidoyl]propyl}-C-hydroxycarbonimidoyl)-6-({2-[(2-{[2-({2,5-dihydroxy-3-[(1-hydroxyethylidene)amino]-6-(hydroxymethyl)oxan-4-yl}oxy)-1-hydroxypropylidene]amino}-1-hydroxypropylidene)amino]-1-hydroxypropylidene}amino)hexanoic acid

Formula:
C32H53O18N7

Smiles:
CC(O)=NC1C(O)OC(CO)C(O)C1OC(C)C(O)=NC(C)C(O)=NC(C)C(O)=NC(CCCC(N)C(=O)O)C(O)=NC(CCC(=O)O)C(O)=NC(CO)C(=O)O

Aglycone:
CC(O)C(O)=NC(C)C(O)=NC(C)C(O)=NC(CCCC(N)C(=O)O)C(O)=NC(CCC(=O)O)C(O)=NC(CO)C(=O)O

Sugarmoiety:
CC(O)=NC1C(O)OC(CO)C(O)C1O

Other Identifiers

Properties
HBA: 25 RingCount: 1
HBD: 15 FractionCSP3: 0.72
AlogP: -1.64 Num_rotatable_bonds: 24
MolWt: 823.81 Num_heavy_atoms: 57
TPSA: 432.84 NumAromaticRings: 0

Unique Aglycone
AD58616
Formula: C24H40O13N6

Smiles:
CC(O)C(O)=NC(C)C(O)=NC(C)C(O)=NC(CCCC(N)C(=O)O)C(O)=NC(CCC(=O)O)C(O)=NC(CO)C(=O)O
HBA: 19 RingCount: 0
HBD: 12 FractionCSP3: 0.67
AlogP: -0.44 Num_rotatable_bonds: 20
MolWt: 620.61 Num_heavy_atoms: 43
TPSA: 341.33 NumAromaticRings: 0

Sugarmoiety
SD04405

CC(O)=NC1C(O)OC(CO)C(O)C1O