Glycoside
...
GD090734

Name:
None

Formula:
C19H27O6N4Cl

Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)C2CCN(c3cc(Cl)ncn3)CC2)[C@@H](O)[C@H](O)[C@@H]1O

Aglycone:
O=C(NCCO)C1CCN(c2cc(Cl)ncn2)CC1

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

Other Identifiers

Properties
HBA: 10 RingCount: 3
HBD: 4 FractionCSP3: 0.72
AlogP: -0.69 Num_rotatable_bonds: 6
MolWt: 430.89 Num_heavy_atoms: 29
TPSA: 137.27 NumAromaticRings: 1

Unique Aglycone
AD39497
Formula: C13H17O2N4Cl

Smiles:
O=C(NCCO)C1CCN(c2cc(Cl)ncn2)CC1
HBA: 6 RingCount: 2
HBD: 2 FractionCSP3: 0.58
AlogP: 0.45 Num_rotatable_bonds: 4
MolWt: 284.75 Num_heavy_atoms: 19
TPSA: 78.35 NumAromaticRings: 1

Sugarmoiety
SD00076

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