Glycoside
...
GD150152

Name:
2-({[(3,4-dihydroxy-5-{[2,3,4-trihydroxy-5-(4-{[1-(4-hydroxy-2-imino-1,2-dihydropteridin-6-yl)ethyl]amino}phenyl)pentyl]oxy}oxolan-2-yl)methoxy](hydroxy)phosphoryl}oxy)pentanedioic acid

Formula:
C29H39O16N6P

Smiles:
CC(Nc1ccc(CC(O)C(O)C(O)COC2OC(COP(=O)(O)OC(CCC(=O)O)C(=O)O)C(O)C2O)cc1)c1cnc2[nH]c(=N)nc(O)c2n1

Aglycone:
COP(=O)(O)OC(CCC(=O)O)C(=O)O.Cc1ccc(NC(C)c2cnc3[nH]c(=N)nc(O)c3n2)cc1

Sugarmoiety:
OC(O)C(O)C(O)COC1OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 22 RingCount: 4
HBD: 12 FractionCSP3: 0.52
AlogP: -1.75 Num_rotatable_bonds: 19
MolWt: 758.63 Num_heavy_atoms: 52
TPSA: 360.54 NumAromaticRings: 3

Unique Aglycone
AD24184
Formula: C6H11O8P

Smiles:
COP(=O)(O)OC(CCC(=O)O)C(=O)O
HBA: 8 RingCount: 0
HBD: 3 FractionCSP3: 0.67
AlogP: 0.07 Num_rotatable_bonds: 7
MolWt: 242.12 Num_heavy_atoms: 15
TPSA: 130.36 NumAromaticRings: 0
AD45171
Formula: C15H16ON6

Smiles:
Cc1ccc(NC(C)c2cnc3[nH]c(=N)nc(O)c3n2)cc1
HBA: 7 RingCount: 3
HBD: 4 FractionCSP3: 0.2
AlogP: 2.02 Num_rotatable_bonds: 3
MolWt: 296.33 Num_heavy_atoms: 22
TPSA: 110.57 NumAromaticRings: 3

Sugarmoiety
SD03436

OC(O)C(O)C(O)COC1OC(O)C(O)C1O