Glycoside
...
GD018425

Name:
None

Formula:
C22H29O9N6P

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

Aglycone:
CCOC(=O)C(C)NP(=O)(OC)Oc1ccccc1.Nc1nc(O)nc2c1N=C[N]2

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

Other Identifiers

Properties
HBA: 15 RingCount: 4
HBD: 6 FractionCSP3: 0.45
AlogP: 0.87 Num_rotatable_bonds: 10
MolWt: 552.48 Num_heavy_atoms: 38
TPSA: 213.4 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
AD05112
Formula: C5H4ON5

Smiles:
Nc1nc(O)nc2c1N=C[N]2
HBA: 6 RingCount: 2
HBD: 3 FractionCSP3: 0.0
AlogP: -0.33 Num_rotatable_bonds: 0
MolWt: 150.12 Num_heavy_atoms: 11
TPSA: 98.49 NumAromaticRings: 1

Sugarmoiety
SD00027

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