Glycoside
...
GD022189

Name:
None

Formula:
C24H33O9N4P

Smiles:
CC(C)C(=O)O[C@@H]1CCN(P(=O)(OC[C@@H]2O[C@H](n3ccc(N)nc3=O)[C@@](C)(O)[C@H]2O)Oc2ccccc2)C1

Aglycone:
COP(=O)(Oc1ccccc1)N1CCC(OC(=O)C(C)C)C1.Nc1cc[nH]c(=O)n1

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

Other Identifiers

Properties
HBA: 13 RingCount: 4
HBD: 4 FractionCSP3: 0.54
AlogP: 1.31 Num_rotatable_bonds: 9
MolWt: 552.52 Num_heavy_atoms: 38
TPSA: 175.67 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
AD15076
Formula: C15H22O5NP

Smiles:
COP(=O)(Oc1ccccc1)N1CCC(OC(=O)C(C)C)C1
HBA: 6 RingCount: 2
HBD: 0 FractionCSP3: 0.53
AlogP: 3.09 Num_rotatable_bonds: 6
MolWt: 327.32 Num_heavy_atoms: 22
TPSA: 65.07 NumAromaticRings: 1

Sugarmoiety
SD00027

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