Glycoside
...
GD026776

Name:
None

Formula:
C26H37O9N4P

Smiles:
C[C@H](NP(=O)(OC[C@@H]1O[C@H](n2ccc(N)nc2=O)[C@@](C)(O)[C@H]1O)Oc1ccccc1)C(=O)OC1CCCCCC1

Aglycone:
COP(=O)(NC(C)C(=O)OC1CCCCCC1)Oc1ccccc1.Nc1cc[nH]c(=O)n1

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

Other Identifiers

Properties
HBA: 13 RingCount: 4
HBD: 5 FractionCSP3: 0.58
AlogP: 2.28 Num_rotatable_bonds: 10
MolWt: 580.58 Num_heavy_atoms: 40
TPSA: 184.46 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
AD17637
Formula: C17H26O5NP

Smiles:
COP(=O)(NC(C)C(=O)OC1CCCCCC1)Oc1ccccc1
HBA: 6 RingCount: 2
HBD: 1 FractionCSP3: 0.59
AlogP: 4.06 Num_rotatable_bonds: 7
MolWt: 355.37 Num_heavy_atoms: 24
TPSA: 73.86 NumAromaticRings: 1

Sugarmoiety
SD00027

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