Glycoside
...
GD020250

Name:
None

Formula:
C24H31O8N5FP

Smiles:
CC[C@H](OP(=O)(N[C@H](C)C(=O)OC)Oc1ccccc1)[C@@H]1O[C@H](n2cc(F)c3c(N)ncnc32)[C@@](C)(O)[C@H]1O

Aglycone:
CCCOP(=O)(NC(C)C(=O)OC)Oc1ccccc1.Nc1ncnc2c1C(F)=C[N]2

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

Other Identifiers

Properties
HBA: 13 RingCount: 4
HBD: 5 FractionCSP3: 0.46
AlogP: 2.3 Num_rotatable_bonds: 10
MolWt: 567.51 Num_heavy_atoms: 39
TPSA: 180.28 NumAromaticRings: 3

Unique Aglycone
AD01026
Formula: C6H4N4F

Smiles:
Nc1ncnc2c1C(F)=C[N]2
HBA: 4 RingCount: 2
HBD: 2 FractionCSP3: 0.0
AlogP: 0.58 Num_rotatable_bonds: 0
MolWt: 151.12 Num_heavy_atoms: 11
TPSA: 65.9 NumAromaticRings: 1
AD14015
Formula: C13H20O5NP

Smiles:
CCCOP(=O)(NC(C)C(=O)OC)Oc1ccccc1
HBA: 6 RingCount: 1
HBD: 1 FractionCSP3: 0.46
AlogP: 2.75 Num_rotatable_bonds: 8
MolWt: 301.28 Num_heavy_atoms: 20
TPSA: 73.86 NumAromaticRings: 1

Sugarmoiety
SD00027

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