Glycoside
...
GD029617

Name:
None

Formula:
C9H12O8N5P

Smiles:
Nc1ncnc2c1ncn2C1OC(O)(OP(=O)(O)O)C(O)C1O

Aglycone:
Nc1ncnc2c1N=C[N]2.O=P(O)(O)O

Sugarmoiety:
OC1OC(O)(O)C(O)C1O

Other Identifiers

Properties
HBA: 13 RingCount: 3
HBD: 7 FractionCSP3: 0.44
AlogP: -2.59 Num_rotatable_bonds: 3
MolWt: 349.2 Num_heavy_atoms: 23
TPSA: 206.3 NumAromaticRings: 2

Unique Aglycone
AD00019
Formula: H3O4P

Smiles:
O=P(O)(O)O
HBA: 4 RingCount: 0
HBD: 3 FractionCSP3: 0.0
AlogP: -0.93 Num_rotatable_bonds: 0
MolWt: 97.99 Num_heavy_atoms: 5
TPSA: 77.76 NumAromaticRings: 0
AD00058
Formula: C5H4N5

Smiles:
Nc1ncnc2c1N=C[N]2
HBA: 5 RingCount: 2
HBD: 2 FractionCSP3: 0.0
AlogP: -0.03 Num_rotatable_bonds: 0
MolWt: 134.12 Num_heavy_atoms: 10
TPSA: 78.26 NumAromaticRings: 1

Sugarmoiety
SD01521

OC1OC(O)(O)C(O)C1O