Glycoside
...
GD001761

Name:
None

Formula:
C24H36O14N7P

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

Aglycone:
COC(=O)CC(NP(=O)(NC(CC(=O)OC)C(=O)OC)OC)C(=O)OC.COc1nc(N)nc2c1N=C[N]2

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

Other Identifiers

Properties
HBA: 21 RingCount: 3
HBD: 6 FractionCSP3: 0.62
AlogP: -2.06 Num_rotatable_bonds: 15
MolWt: 677.56 Num_heavy_atoms: 46
TPSA: 284.1 NumAromaticRings: 2

Unique Aglycone
AD01261
Formula: C6H6ON5

Smiles:
COc1nc(N)nc2c1N=C[N]2
HBA: 6 RingCount: 2
HBD: 2 FractionCSP3: 0.17
AlogP: -0.02 Num_rotatable_bonds: 1
MolWt: 164.15 Num_heavy_atoms: 12
TPSA: 87.49 NumAromaticRings: 1
AD01730
Formula: C13H23O10N2P

Smiles:
COC(=O)CC(NP(=O)(NC(CC(=O)OC)C(=O)OC)OC)C(=O)OC
HBA: 12 RingCount: 0
HBD: 2 FractionCSP3: 0.69
AlogP: -0.87 Num_rotatable_bonds: 11
MolWt: 398.31 Num_heavy_atoms: 26
TPSA: 155.56 NumAromaticRings: 0

Sugarmoiety
SD00027

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