Glycoside
...
GD098234

Name:
None

Formula:
C20H18O8N5Cl

Smiles:
COC(=O)c1ccc(-c2cn([C@]3(CO)O[C@@H](n4ccc(=O)[nH]c4=O)[C@@H](O)[C@@H]3O)nn2)cc1Cl

Aglycone:
COC(=O)c1ccc(C2=C[N]N=N2)cc1Cl.O=c1cc[nH]c(=O)[nH]1

Sugarmoiety:
OCC1(O)OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 13 RingCount: 4
HBD: 4 FractionCSP3: 0.32
AlogP: -1.17 Num_rotatable_bonds: 5
MolWt: 479.83 Num_heavy_atoms: 33
TPSA: 181.79 NumAromaticRings: 3

Unique Aglycone
AD00106
Formula: C4H4O2N2

Smiles:
O=c1cc[nH]c(=O)[nH]1
HBA: 4 RingCount: 1
HBD: 2 FractionCSP3: 0.0
AlogP: -0.94 Num_rotatable_bonds: 0
MolWt: 112.09 Num_heavy_atoms: 8
TPSA: 65.72 NumAromaticRings: 1
AD41800
Formula: C11H7O2N3Cl

Smiles:
COC(=O)c1ccc(C2=C[N]N=N2)cc1Cl
HBA: 5 RingCount: 2
HBD: 0 FractionCSP3: 0.1
AlogP: 2.41 Num_rotatable_bonds: 2
MolWt: 236.64 Num_heavy_atoms: 16
TPSA: 65.12 NumAromaticRings: 1

Sugarmoiety
SD01068

OCC1(O)OC(O)C(O)C1O