Glycoside
...
GD092970

Name:
None

Formula:
C23H22O5N4

Smiles:
Cc1cc(C(=O)OC[C@H](O)[C@H](O)[C@H](O)c2cnn(-c3ccccc3)n2)c2ccccc2n1

Aglycone:
Cc1cc(C=O)c2ccccc2n1.c1ccc(-n2nccn2)cc1

Sugarmoiety:
OOCC(O)C(O)C(O)O

Other Identifiers

Properties
HBA: 9 RingCount: 4
HBD: 3 FractionCSP3: 0.22
AlogP: 1.74 Num_rotatable_bonds: 7
MolWt: 434.45 Num_heavy_atoms: 32
TPSA: 130.59 NumAromaticRings: 4

Unique Aglycone
AD05614
Formula: C8H7N3

Smiles:
c1ccc(-n2nccn2)cc1
HBA: 3 RingCount: 2
HBD: 0 FractionCSP3: 0.0
AlogP: 1.27 Num_rotatable_bonds: 1
MolWt: 145.17 Num_heavy_atoms: 11
TPSA: 30.71 NumAromaticRings: 2
AD40380
Formula: C11H9ON

Smiles:
Cc1cc(C=O)c2ccccc2n1
HBA: 2 RingCount: 2
HBD: 0 FractionCSP3: 0.09
AlogP: 2.36 Num_rotatable_bonds: 1
MolWt: 171.2 Num_heavy_atoms: 13
TPSA: 29.96 NumAromaticRings: 2

Sugarmoiety
SD01759

OOCC(O)C(O)C(O)O