Glycoside
...
GD026633

Name:
None

Formula:
C17H27O14N6P3I

Smiles:
O=C(CI)NCCCCCNc1ncnc2c1ncn2C1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)([O-])O)[C@H](O)[C@H]1O

Aglycone:
COP(=O)(O)OP(=O)(O)OP(=O)([O-])O.O=C(CI)NCCCCCNc1ncnc2c1N=C[N]2

Sugarmoiety:
OC1OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 20 RingCount: 3
HBD: 7 FractionCSP3: 0.65
AlogP: -0.71 Num_rotatable_bonds: 16
MolWt: 759.26 Num_heavy_atoms: 41
TPSA: 297.07 NumAromaticRings: 2

Unique Aglycone
AD09002
Formula: C12H16ON6I

Smiles:
O=C(CI)NCCCCCNc1ncnc2c1N=C[N]2
HBA: 7 RingCount: 2
HBD: 2 FractionCSP3: 0.5
AlogP: 1.52 Num_rotatable_bonds: 8
MolWt: 387.21 Num_heavy_atoms: 20
TPSA: 93.37 NumAromaticRings: 1
AD09054
Formula: CH6O10P3

Smiles:
COP(=O)(O)OP(=O)(O)OP(=O)([O-])O
HBA: 10 RingCount: 0
HBD: 3 FractionCSP3: 1.0
AlogP: -0.67 Num_rotatable_bonds: 5
MolWt: 270.97 Num_heavy_atoms: 14
TPSA: 162.65 NumAromaticRings: 0

Sugarmoiety
SD00018

OC1OC(O)C(O)C1O