Glycoside
...
GD029571

Name:
None

Formula:
C20H35O9N4P

Smiles:
CCCC(CCC)C(=O)OCCNP(=O)(O)OC[C@@H]1O[C@H](n2ccc(N)nc2=O)[C@@](C)(O)[C@H]1O

Aglycone:
CCCC(CCC)C(=O)OCCNP(=O)(O)OC.Nc1cc[nH]c(=O)n1

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

Other Identifiers

Properties
HBA: 13 RingCount: 2
HBD: 6 FractionCSP3: 0.75
AlogP: 0.3 Num_rotatable_bonds: 13
MolWt: 506.49 Num_heavy_atoms: 34
TPSA: 195.46 NumAromaticRings: 1

Unique Aglycone
AD00115
Formula: C4H5ON3

Smiles:
Nc1cc[nH]c(=O)n1
HBA: 4 RingCount: 1
HBD: 3 FractionCSP3: 0.0
AlogP: -0.65 Num_rotatable_bonds: 0
MolWt: 111.1 Num_heavy_atoms: 8
TPSA: 71.77 NumAromaticRings: 1
AD19225
Formula: C11H24O5NP

Smiles:
CCCC(CCC)C(=O)OCCNP(=O)(O)OC
HBA: 6 RingCount: 0
HBD: 2 FractionCSP3: 0.91
AlogP: 2.08 Num_rotatable_bonds: 10
MolWt: 281.29 Num_heavy_atoms: 18
TPSA: 84.86 NumAromaticRings: 0

Sugarmoiety
SD00027

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