Glycoside
...
GD081022

Name:
None

Formula:
C18H24O7N4

Smiles:
CC(=O)N[C@H]1[C@H](OCCn2cc(-c3cccc(O)c3)nn2)O[C@H](CO)[C@@H](O)[C@@H]1O

Aglycone:
OCCn1cc(-c2cccc(O)c2)nn1

Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 3
HBD: 5 FractionCSP3: 0.5
AlogP: -1.39 Num_rotatable_bonds: 7
MolWt: 408.41 Num_heavy_atoms: 29
TPSA: 159.19 NumAromaticRings: 2

Unique Aglycone
AD36547
Formula: C10H11O2N3

Smiles:
OCCn1cc(-c2cccc(O)c2)nn1
HBA: 5 RingCount: 2
HBD: 2 FractionCSP3: 0.2
AlogP: 0.64 Num_rotatable_bonds: 3
MolWt: 205.22 Num_heavy_atoms: 15
TPSA: 71.17 NumAromaticRings: 2

Sugarmoiety
SD00014

CC(=O)NC1C(O)OC(CO)C(O)C1O