Glycoside
...
GD016743

Name:
None

Formula:
C23H30O9N7P

Smiles:
CCOC(=O)C1(NP(=O)(OC[C@]2(N=[N+]=[N-])O[C@H](n3ccc(N)nc3=O)[C@H](O)[C@H]2O)Oc2ccccc2)CCCC1

Aglycone:
CCOC(=O)C1(NP(=O)(OC)Oc2ccccc2)CCCC1.Nc1cc[nH]c(=O)n1

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

Other Identifiers

Properties
HBA: 16 RingCount: 4
HBD: 5 FractionCSP3: 0.52
AlogP: 1.75 Num_rotatable_bonds: 11
MolWt: 579.51 Num_heavy_atoms: 40
TPSA: 233.22 NumAromaticRings: 2

Unique Aglycone
AD00115
Formula: C4H5ON3

Smiles:
Nc1cc[nH]c(=O)n1
HBA: 4 RingCount: 1
HBD: 3 FractionCSP3: 0.0
AlogP: -0.65 Num_rotatable_bonds: 0
MolWt: 111.1 Num_heavy_atoms: 8
TPSA: 71.77 NumAromaticRings: 1
AD12016
Formula: C15H22O5NP

Smiles:
CCOC(=O)C1(NP(=O)(OC)Oc2ccccc2)CCCC1
HBA: 6 RingCount: 2
HBD: 1 FractionCSP3: 0.53
AlogP: 3.29 Num_rotatable_bonds: 7
MolWt: 327.32 Num_heavy_atoms: 22
TPSA: 73.86 NumAromaticRings: 1

Sugarmoiety
SD00111

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