Glycoside
GD048385
Name:
NoneFormula:
C13H19O6N3Smiles:
O=C(C(=O)N1CCc2nccn2CC1)[C@H](O)[C@H](O)[C@H](O)COAglycone:
c1cn2c(n1)CCNCC2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -3.09 | Num_rotatable_bonds: | 5 |
| MolWt: | 313.31 | Num_heavy_atoms: | 22 |
| TPSA: | 136.12 | NumAromaticRings: | 1 |
Unique Aglycone
AD25877
Formula: C7H11N3
Smiles:
c1cn2c(n1)CCNCC2| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.57 |
| AlogP: | 0.03 | Num_rotatable_bonds: | 0 |
| MolWt: | 137.19 | Num_heavy_atoms: | 10 |
| TPSA: | 29.85 | NumAromaticRings: | 1 |
