Glycoside
...
GD032885

Name:
None

Formula:
C21H29O10N4P

Smiles:
COC(=O)[C@H](C)NP(=O)(OC[C@@H]1O[C@H](n2ccc(N)nc2=O)[C@@](C)(O)[C@H]1O)Oc1ccc(OC)cc1

Aglycone:
COC(=O)C(C)NP(=O)(OC)Oc1ccc(OC)cc1.Nc1cc[nH]c(=O)n1

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

Other Identifiers

Properties
HBA: 14 RingCount: 3
HBD: 5 FractionCSP3: 0.48
AlogP: 0.2 Num_rotatable_bonds: 10
MolWt: 528.46 Num_heavy_atoms: 36
TPSA: 193.69 NumAromaticRings: 2

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
AD09009
Formula: C12H18O6NP

Smiles:
COC(=O)C(C)NP(=O)(OC)Oc1ccc(OC)cc1
HBA: 7 RingCount: 1
HBD: 1 FractionCSP3: 0.42
AlogP: 1.98 Num_rotatable_bonds: 7
MolWt: 303.25 Num_heavy_atoms: 20
TPSA: 83.09 NumAromaticRings: 1

Sugarmoiety
SD00027

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