Glycoside
GD075653
Name:
NoneFormula:
C18H33O7N2Smiles:
CC(C)(C)N(C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)[C@H]1COC2(CC[NH2+]CC2)C1Aglycone:
CC(C)(C)NC1COC2(CC[NH2+]CC2)C1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.89 |
| AlogP: | -2.86 | Num_rotatable_bonds: | 6 |
| MolWt: | 389.47 | Num_heavy_atoms: | 27 |
| TPSA: | 144.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD35049
Formula: C12H25ON2
Smiles:
CC(C)(C)NC1COC2(CC[NH2+]CC2)C1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 0.26 | Num_rotatable_bonds: | 1 |
| MolWt: | 213.34 | Num_heavy_atoms: | 15 |
| TPSA: | 37.87 | NumAromaticRings: | 0 |
