Glycoside
...
GD035895

Name:
None

Formula:
C23H31O10N4P

Smiles:
CC(C)OC(=O)[C@H](C)N[P@@](=O)(OC[C@@H]1O[C@H](n2cc(C(N)=O)ncc2=O)[C@@](C)(O)[C@H]1O)Oc1ccccc1

Aglycone:
COP(=O)(NC(C)C(=O)OC(C)C)Oc1ccccc1.NC(=O)c1c[nH]c(=O)cn1

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

Other Identifiers

Properties
HBA: 14 RingCount: 3
HBD: 5 FractionCSP3: 0.48
AlogP: 0.48 Num_rotatable_bonds: 11
MolWt: 554.49 Num_heavy_atoms: 38
TPSA: 201.53 NumAromaticRings: 2

Unique Aglycone
AD04990
Formula: C13H20O5NP

Smiles:
COP(=O)(NC(C)C(=O)OC(C)C)Oc1ccccc1
HBA: 6 RingCount: 1
HBD: 1 FractionCSP3: 0.46
AlogP: 2.75 Num_rotatable_bonds: 7
MolWt: 301.28 Num_heavy_atoms: 20
TPSA: 73.86 NumAromaticRings: 1
AD22681
Formula: C5H5O2N3

Smiles:
NC(=O)c1c[nH]c(=O)cn1
HBA: 5 RingCount: 1
HBD: 3 FractionCSP3: 0.0
AlogP: -1.13 Num_rotatable_bonds: 1
MolWt: 139.11 Num_heavy_atoms: 10
TPSA: 88.84 NumAromaticRings: 1

Sugarmoiety
SD00027

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