Glycoside
GD082454
Name:
NoneFormula:
C19H26O6N5Smiles:
O=C(C(=O)N(Cc1cnc2n1CC[NH2+]CC2)c1ccccn1)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
c1ccc(NCc2cnc3n2CC[NH2+]CC3)nc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.47 |
| AlogP: | -3.43 | Num_rotatable_bonds: | 8 |
| MolWt: | 420.45 | Num_heavy_atoms: | 30 |
| TPSA: | 165.62 | NumAromaticRings: | 2 |
Unique Aglycone
AD37051
Formula: C13H18N5
Smiles:
c1ccc(NCc2cnc3n2CC[NH2+]CC3)nc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.38 |
| AlogP: | 0.01 | Num_rotatable_bonds: | 3 |
| MolWt: | 244.32 | Num_heavy_atoms: | 18 |
| TPSA: | 59.35 | NumAromaticRings: | 2 |
