Glycoside
...
GD155547

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

Formula:
C26H44O14N6

Smiles:
CC(N=C(O)C(C)OC1C(O)C(CO)OC(O)C1CC(=N)O)C(O)=NC(CCC(O)=NC(CCCC(N)C(=N)O)C(=O)O)C(=O)O

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

Sugarmoiety:
N=C(O)CC1C(O)OC(CO)C(O)C1O

Other Identifiers

Properties
HBA: 20 RingCount: 1
HBD: 14 FractionCSP3: 0.73
AlogP: -0.65 Num_rotatable_bonds: 20
MolWt: 664.67 Num_heavy_atoms: 46
TPSA: 365.7 NumAromaticRings: 0

Unique Aglycone
AD55605
Formula: C18H31O9N5

Smiles:
CC(O)C(O)=NC(C)C(O)=NC(CCC(O)=NC(CCCC(N)C(=N)O)C(=O)O)C(=O)O
HBA: 14 RingCount: 0
HBD: 10 FractionCSP3: 0.67
AlogP: 0.34 Num_rotatable_bonds: 15
MolWt: 461.47 Num_heavy_atoms: 32
TPSA: 262.7 NumAromaticRings: 0

Sugarmoiety
SD05854

N=C(O)CC1C(O)OC(CO)C(O)C1O