Glycoside
...
GD006709

Name:
None

Formula:
C19H31O9N6P

Smiles:
CC(C)O[C@@H]1[C@@H](n2cnc3c(=O)[nH]c(N)nc32)O[C@@H](COP(=O)(O)NCCC(=O)O)[C@H]1OC(C)C

Aglycone:
COP(=O)(O)NCCC(=O)O.Nc1nc2c(c(=O)[nH]1)N=C[N]2

Sugarmoiety:
CC(C)OC1C(O)OC(O)C1OC(C)C

Other Identifiers

Properties
HBA: 15 RingCount: 3
HBD: 6 FractionCSP3: 0.68
AlogP: 0.37 Num_rotatable_bonds: 12
MolWt: 518.46 Num_heavy_atoms: 35
TPSA: 213.14 NumAromaticRings: 2

Unique Aglycone
AD00207
Formula: C5H4ON5

Smiles:
Nc1nc2c(c(=O)[nH]1)N=C[N]2
HBA: 6 RingCount: 2
HBD: 3 FractionCSP3: 0.0
AlogP: -0.74 Num_rotatable_bonds: 0
MolWt: 150.12 Num_heavy_atoms: 11
TPSA: 98.23 NumAromaticRings: 1
AD05520
Formula: C4H10O5NP

Smiles:
COP(=O)(O)NCCC(=O)O
HBA: 6 RingCount: 0
HBD: 3 FractionCSP3: 0.75
AlogP: -0.2 Num_rotatable_bonds: 5
MolWt: 183.1 Num_heavy_atoms: 11
TPSA: 95.86 NumAromaticRings: 0

Sugarmoiety
SD00754

CC(C)OC1C(O)OC(O)C1OC(C)C