Glycoside
GD075848
Name:
NoneFormula:
C19H27O6N2Smiles:
O=C(C(=O)N1CCC2(CC1)[NH2+]CCc1ccccc12)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
c1ccc2c(c1)CC[NH2+]C21CCNCC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.58 |
| AlogP: | -2.73 | Num_rotatable_bonds: | 5 |
| MolWt: | 379.43 | Num_heavy_atoms: | 27 |
| TPSA: | 134.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD35127
Formula: C13H19N2
Smiles:
c1ccc2c(c1)CC[NH2+]C21CCNCC1| HBA: | 2 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.54 |
| AlogP: | 0.38 | Num_rotatable_bonds: | 0 |
| MolWt: | 203.31 | Num_heavy_atoms: | 15 |
| TPSA: | 28.64 | NumAromaticRings: | 1 |
