Glycoside
...
GD023592

Name:
None

Formula:
C18H27O9N6P

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

Aglycone:
COP(=O)([O-])NCC(=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: 4 FractionCSP3: 0.67
AlogP: -1.99 Num_rotatable_bonds: 11
MolWt: 502.42 Num_heavy_atoms: 34
TPSA: 218.8 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
AD15852
Formula: C3H6O5NP

Smiles:
COP(=O)([O-])NCC(=O)[O-]
HBA: 6 RingCount: 0
HBD: 1 FractionCSP3: 0.67
AlogP: -2.56 Num_rotatable_bonds: 4
MolWt: 167.06 Num_heavy_atoms: 10
TPSA: 101.52 NumAromaticRings: 0

Sugarmoiety
SD00754

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