Glycoside
GD053442
Name:
NoneFormula:
C15H21O6N3Smiles:
NCc1ccc2c(n1)N(C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)CCC2Aglycone:
NCc1ccc2c(n1)NCCC2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.53 |
| AlogP: | -2.54 | Num_rotatable_bonds: | 6 |
| MolWt: | 339.35 | Num_heavy_atoms: | 24 |
| TPSA: | 157.21 | NumAromaticRings: | 1 |
Unique Aglycone
AD27282
Formula: C9H13N3
Smiles:
NCc1ccc2c(n1)NCCC2| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.44 |
| AlogP: | 0.9 | Num_rotatable_bonds: | 1 |
| MolWt: | 163.22 | Num_heavy_atoms: | 12 |
| TPSA: | 50.94 | NumAromaticRings: | 1 |
