Glycoside
GD054980
Name:
NoneFormula:
C15H21O6N3Smiles:
O=C(C(=O)N1CCC(c2ncccn2)CC1)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
c1cnc(C2CCNCC2)nc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.6 |
| AlogP: | -2.17 | Num_rotatable_bonds: | 6 |
| MolWt: | 339.35 | Num_heavy_atoms: | 24 |
| TPSA: | 144.08 | NumAromaticRings: | 1 |
Unique Aglycone
AD27945
Formula: C9H13N3
Smiles:
c1cnc(C2CCNCC2)nc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.56 |
| AlogP: | 0.94 | Num_rotatable_bonds: | 1 |
| MolWt: | 163.22 | Num_heavy_atoms: | 12 |
| TPSA: | 37.81 | NumAromaticRings: | 1 |
