Glycoside
GD088807
Name:
NoneFormula:
C22H33O7N2Smiles:
O=C(C(=O)N1[C@H](COCc2ccccc2)CCC12CC[NH2+]CC2)[C@H](O)[C@H](O)[C@@H](O)COAglycone:
c1ccc(COCC2CCC3(CC[NH2+]CC3)N2)cc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.64 |
| AlogP: | -2.07 | Num_rotatable_bonds: | 9 |
| MolWt: | 437.51 | Num_heavy_atoms: | 31 |
| TPSA: | 144.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD38856
Formula: C16H25ON2
Smiles:
c1ccc(COCC2CCC3(CC[NH2+]CC3)N2)cc1| HBA: | 3 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.62 |
| AlogP: | 1.05 | Num_rotatable_bonds: | 4 |
| MolWt: | 261.39 | Num_heavy_atoms: | 19 |
| TPSA: | 37.87 | NumAromaticRings: | 1 |
