Glycoside
...
GD029185

Name:
None

Formula:
C22H31O8N8P

Smiles:
CCOC(=O)[C@H](C)NP(=O)(OC[C@@H]1O[C@H](n2cnc3c(N)nc(NN)nc32)[C@@](C)(O)[C@H]1O)Oc1ccccc1

Aglycone:
CCOC(=O)C(C)NP(=O)(OC)Oc1ccccc1.NNc1nc(N)c2c(n1)[N]C=N2

Sugarmoiety:
CC1(O)C(O)OC(O)C1O

Other Identifiers

Properties
HBA: 16 RingCount: 4
HBD: 8 FractionCSP3: 0.45
AlogP: 0.45 Num_rotatable_bonds: 11
MolWt: 566.51 Num_heavy_atoms: 39
TPSA: 231.22 NumAromaticRings: 3

Unique Aglycone
AD00514
Formula: C12H18O5NP

Smiles:
CCOC(=O)C(C)NP(=O)(OC)Oc1ccccc1
HBA: 6 RingCount: 1
HBD: 1 FractionCSP3: 0.42
AlogP: 2.36 Num_rotatable_bonds: 7
MolWt: 287.25 Num_heavy_atoms: 19
TPSA: 73.86 NumAromaticRings: 1
AD09840
Formula: C5H6N7

Smiles:
NNc1nc(N)c2c(n1)[N]C=N2
HBA: 7 RingCount: 2
HBD: 5 FractionCSP3: 0.0
AlogP: -0.75 Num_rotatable_bonds: 1
MolWt: 164.15 Num_heavy_atoms: 12
TPSA: 116.31 NumAromaticRings: 1

Sugarmoiety
SD00027

CC1(O)C(O)OC(O)C1O