Glycoside
GD060573
Name:
NoneFormula:
C17H20O6N2Smiles:
O=C(c1nc(-c2cccc3c2CCCC3)no1)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
c1cc2c(c(-c3ncon3)c1)CCCC2Sugarmoiety:
O=C(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -0.13 | Num_rotatable_bonds: | 6 |
| MolWt: | 348.35 | Num_heavy_atoms: | 25 |
| TPSA: | 136.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD29894
Formula: C12H12ON2
Smiles:
c1cc2c(c(-c3ncon3)c1)CCCC2| HBA: | 3 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.33 |
| AlogP: | 2.62 | Num_rotatable_bonds: | 1 |
| MolWt: | 200.24 | Num_heavy_atoms: | 15 |
| TPSA: | 38.92 | NumAromaticRings: | 2 |
