Glycoside
GD053417
Name:
NoneFormula:
C15H23O6N3Smiles:
OC[C@H]1O[C@H](O)[C@H](Nc2cccc(N3CCOCC3)n2)[C@@H](O)[C@@H]1OAglycone:
Nc1cccc(N2CCOCC2)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -1.87 | Num_rotatable_bonds: | 4 |
| MolWt: | 341.36 | Num_heavy_atoms: | 24 |
| TPSA: | 127.54 | NumAromaticRings: | 1 |
Unique Aglycone
AD27275
Formula: C9H13ON3
Smiles:
Nc1cccc(N2CCOCC2)n1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.44 |
| AlogP: | 0.5 | Num_rotatable_bonds: | 1 |
| MolWt: | 179.22 | Num_heavy_atoms: | 13 |
| TPSA: | 51.38 | NumAromaticRings: | 1 |
