Glycoside
...
GD010584

Name:
None

Formula:
C25H36O11N5P

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

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

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

Other Identifiers

Properties
HBA: 16 RingCount: 3
HBD: 7 FractionCSP3: 0.52
AlogP: -0.38 Num_rotatable_bonds: 13
MolWt: 613.56 Num_heavy_atoms: 42
TPSA: 236.78 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
AD08152
Formula: C16H25O7N2P

Smiles:
CCOC(=O)C(C)NP(=O)(OC)Oc1ccc(CC(N)C(=O)OC)cc1
HBA: 9 RingCount: 1
HBD: 3 FractionCSP3: 0.5
AlogP: 1.4 Num_rotatable_bonds: 10
MolWt: 388.36 Num_heavy_atoms: 26
TPSA: 126.18 NumAromaticRings: 1

Sugarmoiety
SD00027

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