Glycoside
...
GD018240

Name:
None

Formula:
C23H30O8N9P

Smiles:
C[C@H](NP(=O)(OC[C@]1(N=[N+]=[N-])O[C@H](n2cnc3c(N)ncnc32)[C@H](O)[C@H]1O)Oc1ccccc1)C(=O)OC(C)(C)C

Aglycone:
COP(=O)(NC(C)C(=O)OC(C)(C)C)Oc1ccccc1.Nc1ncnc2c1N=C[N]2

Sugarmoiety:
[N-]=[N+]=NC1(O)OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 17 RingCount: 4
HBD: 5 FractionCSP3: 0.48
AlogP: 2.19 Num_rotatable_bonds: 10
MolWt: 591.52 Num_heavy_atoms: 41
TPSA: 241.93 NumAromaticRings: 3

Unique Aglycone
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
AD12125
Formula: C14H22O5NP

Smiles:
COP(=O)(NC(C)C(=O)OC(C)(C)C)Oc1ccccc1
HBA: 6 RingCount: 1
HBD: 1 FractionCSP3: 0.5
AlogP: 3.14 Num_rotatable_bonds: 6
MolWt: 315.31 Num_heavy_atoms: 21
TPSA: 73.86 NumAromaticRings: 1

Sugarmoiety
SD00111

[N-]=[N+]=NC1(O)OC(O)C(O)C1O