Glycoside
...
GD082314

Name:
None

Formula:
C17H20O6N5Cl

Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2cc(Cl)ccc2-n2cnnn2)[C@@H](O)[C@H](O)[C@@H]1O

Aglycone:
O=C(NCCO)c1cc(Cl)ccc1-n1cnnn1

Sugarmoiety:
CC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 3
HBD: 4 FractionCSP3: 0.5
AlogP: -1.11 Num_rotatable_bonds: 6
MolWt: 413.82 Num_heavy_atoms: 28
TPSA: 151.85 NumAromaticRings: 2

Unique Aglycone
AD36975
Formula: C11H10O2N5Cl

Smiles:
O=C(NCCO)c1cc(Cl)ccc1-n1cnnn1
HBA: 7 RingCount: 2
HBD: 2 FractionCSP3: 0.2
AlogP: 0.04 Num_rotatable_bonds: 4
MolWt: 267.68 Num_heavy_atoms: 18
TPSA: 92.93 NumAromaticRings: 2

Sugarmoiety
SD00076

CC1OC(O)C(O)C(O)C1O