Glycoside
GD065900
Name:
NoneFormula:
C16H21O6N3Smiles:
O=C(C(=O)N1CCc2nc(C3CC3)ncc2C1)[C@H](O)[C@H](O)[C@H](O)COAglycone:
c1nc(C2CC2)nc2c1CNCC2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -2.12 | Num_rotatable_bonds: | 6 |
| MolWt: | 351.36 | Num_heavy_atoms: | 25 |
| TPSA: | 144.08 | NumAromaticRings: | 1 |
Unique Aglycone
AD31672
Formula: C10H13N3
Smiles:
c1nc(C2CC2)nc2c1CNCC2| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.6 |
| AlogP: | 1.0 | Num_rotatable_bonds: | 1 |
| MolWt: | 175.23 | Num_heavy_atoms: | 13 |
| TPSA: | 37.81 | NumAromaticRings: | 1 |
