Glycoside
GD081472
Name:
NoneFormula:
C19H25O7N3Smiles:
O=C1NC2(CCN(C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)CC2)C[C@H]1c1cccnc1Aglycone:
O=C1NC2(CCNCC2)CC1c1cccnc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -2.31 | Num_rotatable_bonds: | 6 |
| MolWt: | 407.42 | Num_heavy_atoms: | 29 |
| TPSA: | 160.29 | NumAromaticRings: | 1 |
Unique Aglycone
AD36685
Formula: C13H17ON3
Smiles:
O=C1NC2(CCNCC2)CC1c1cccnc1| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.54 |
| AlogP: | 0.81 | Num_rotatable_bonds: | 1 |
| MolWt: | 231.3 | Num_heavy_atoms: | 17 |
| TPSA: | 54.02 | NumAromaticRings: | 1 |
