Glycoside
...
GD071423

Name:
None

Formula:
C18H27O6N3

Smiles:
O=C(NCC1CCN(Cc2ccncc2)CC1)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO

Aglycone:
NCC1CCN(Cc2ccncc2)CC1

Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)CO

Other Identifiers

Properties
HBA: 9 RingCount: 2
HBD: 5 FractionCSP3: 0.61
AlogP: -1.95 Num_rotatable_bonds: 9
MolWt: 381.43 Num_heavy_atoms: 27
TPSA: 143.22 NumAromaticRings: 1

Unique Aglycone
AD33582
Formula: C12H19N3

Smiles:
NCC1CCN(Cc2ccncc2)CC1
HBA: 3 RingCount: 2
HBD: 2 FractionCSP3: 0.58
AlogP: 1.25 Num_rotatable_bonds: 3
MolWt: 205.31 Num_heavy_atoms: 15
TPSA: 42.15 NumAromaticRings: 1

Sugarmoiety
SD00818

O=C(O)C(=O)C(O)C(O)C(O)CO