Glycoside
...
GD019515

Name:
None

Formula:
C25H31O9N4P

Smiles:
CCOC(=O)[C@H](C)NP(=O)(OC[C@@H]1O[C@H](n2ccc(N)nc2=O)[C@@](C)(O)[C@H]1O)Oc1cccc2ccccc12

Aglycone:
CCOC(=O)C(C)NP(=O)(OC)Oc1cccc2ccccc12.Nc1cc[nH]c(=O)n1

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

Other Identifiers

Properties
HBA: 13 RingCount: 4
HBD: 5 FractionCSP3: 0.4
AlogP: 1.73 Num_rotatable_bonds: 10
MolWt: 562.52 Num_heavy_atoms: 39
TPSA: 184.46 NumAromaticRings: 3

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
AD04567
Formula: C16H20O5NP

Smiles:
CCOC(=O)C(C)NP(=O)(OC)Oc1cccc2ccccc12
HBA: 6 RingCount: 2
HBD: 1 FractionCSP3: 0.31
AlogP: 3.51 Num_rotatable_bonds: 7
MolWt: 337.31 Num_heavy_atoms: 23
TPSA: 73.86 NumAromaticRings: 2

Sugarmoiety
SD00027

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