Glycoside
...
GD150356

Name:
{[5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-2-{[({[(2-{[5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl)oxy](hydroxy)phosphoryl}oxy)methoxy]methyl}oxolan-3-yl]oxy}({[5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy}methoxy)phosphinic acid

Formula:
C35H51O23N9P2

Smiles:
N=c1ccn(C2CC(O)C(COCOP(=O)(O)OC3CC(n4ccc(=N)nc4O)OC3COCOP(=O)(O)OC3C(O)C(CO)OC(OCC4OC(n5ccc(=N)nc5O)CC4O)C3O)O2)c(O)n1

Aglycone:
N=c1ccn(C2CC(O)C(CO)O2)c(O)n1.N=c1ccn(C2CC(O)C(COCOP(=O)(O)OC3CC(n4ccc(=N)nc4O)OC3COCOP(=O)(O)O)O2)c(O)n1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 32 RingCount: 7
HBD: 13 FractionCSP3: 0.66
AlogP: -3.78 Num_rotatable_bonds: 21
MolWt: 1027.78 Num_heavy_atoms: 69
TPSA: 462.98 NumAromaticRings: 3

Unique Aglycone
AD49338
Formula: C20H30O15N6P2

Smiles:
N=c1ccn(C2CC(O)C(COCOP(=O)(O)OC3CC(n4ccc(=N)nc4O)OC3COCOP(=O)(O)O)O2)c(O)n1
HBA: 21 RingCount: 4
HBD: 8 FractionCSP3: 0.6
AlogP: -1.35 Num_rotatable_bonds: 14
MolWt: 656.44 Num_heavy_atoms: 43
TPSA: 303.47 NumAromaticRings: 2
AD60067
Formula: C9H13O4N3

Smiles:
N=c1ccn(C2CC(O)C(CO)O2)c(O)n1
HBA: 7 RingCount: 2
HBD: 4 FractionCSP3: 0.56
AlogP: -1.29 Num_rotatable_bonds: 2
MolWt: 227.22 Num_heavy_atoms: 16
TPSA: 111.59 NumAromaticRings: 1

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O