Glycoside
GD086562
Name:
NoneFormula:
C20H35O7N3Smiles:
CN1CCN(C[C@H]2CCC[C@]3(CCN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)C3)O2)CC1Aglycone:
CN1CCN(CC2CCCC3(CCNC3)O2)CC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.9 |
| AlogP: | -2.58 | Num_rotatable_bonds: | 7 |
| MolWt: | 429.51 | Num_heavy_atoms: | 30 |
| TPSA: | 134.01 | NumAromaticRings: | 0 |
Unique Aglycone
AD38314
Formula: C14H27ON3
Smiles:
CN1CCN(CC2CCCC3(CCNC3)O2)CC1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 0.54 | Num_rotatable_bonds: | 2 |
| MolWt: | 253.39 | Num_heavy_atoms: | 18 |
| TPSA: | 27.74 | NumAromaticRings: | 0 |
