Glycoside
...
GD025658

Name:
None

Formula:
C23H31O9N4P

Smiles:
C=CCO[C@@H]1[C@H](O)[C@H](COP(=O)(NC(C)C(=O)OCC)Oc2ccccc2)O[C@H]1n1ccc(N)nc1=O

Aglycone:
CCOC(=O)C(C)NP(=O)(OC)Oc1ccccc1.Nc1cc[nH]c(=O)n1

Sugarmoiety:
C=CCOC1C(O)OC(O)C1O

Other Identifiers

Properties
HBA: 13 RingCount: 3
HBD: 4 FractionCSP3: 0.43
AlogP: 1.4 Num_rotatable_bonds: 13
MolWt: 538.49 Num_heavy_atoms: 37
TPSA: 173.46 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
AD00514
Formula: C12H18O5NP

Smiles:
CCOC(=O)C(C)NP(=O)(OC)Oc1ccccc1
HBA: 6 RingCount: 1
HBD: 1 FractionCSP3: 0.42
AlogP: 2.36 Num_rotatable_bonds: 7
MolWt: 287.25 Num_heavy_atoms: 19
TPSA: 73.86 NumAromaticRings: 1

Sugarmoiety
SD02664

C=CCOC1C(O)OC(O)C1O