Glycoside
...
GD026974

Name:
None

Formula:
C25H25O10N3

Smiles:
CC(=O)O[C@H]1[C@@H](C)O[C@@H](n2cc(COC3=CC(=O)c4ccccc4C3=O)nn2)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:
O=C1C=C(OCC2=C[N]N=N2)C(=O)c2ccccc21

Sugarmoiety:
CC(=O)OC1C(C)OC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 13 RingCount: 4
HBD: 0 FractionCSP3: 0.4
AlogP: 1.47 Num_rotatable_bonds: 7
MolWt: 527.49 Num_heavy_atoms: 38
TPSA: 162.21 NumAromaticRings: 2

Unique Aglycone
AD17754
Formula: C13H8O3N3

Smiles:
O=C1C=C(OCC2=C[N]N=N2)C(=O)c2ccccc21
HBA: 6 RingCount: 3
HBD: 0 FractionCSP3: 0.08
AlogP: 1.79 Num_rotatable_bonds: 3
MolWt: 254.22 Num_heavy_atoms: 19
TPSA: 82.19 NumAromaticRings: 1

Sugarmoiety
SD00522

CC(=O)OC1C(C)OC(O)C(OC(C)=O)C1OC(C)=O