Glycoside
GD074045
Name:
NoneFormula:
C16H23O6N3SSmiles:
Cc1ncsc1CN1CC2(C1)CN(C(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)C2Aglycone:
Cc1ncsc1CN1CC2(CNC2)C1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.69 |
| AlogP: | -2.26 | Num_rotatable_bonds: | 7 |
| MolWt: | 385.44 | Num_heavy_atoms: | 26 |
| TPSA: | 134.43 | NumAromaticRings: | 1 |
Unique Aglycone
AD34234
Formula: C10H15N3S
Smiles:
Cc1ncsc1CN1CC2(CNC2)C1| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.7 |
| AlogP: | 0.86 | Num_rotatable_bonds: | 2 |
| MolWt: | 209.32 | Num_heavy_atoms: | 14 |
| TPSA: | 28.16 | NumAromaticRings: | 1 |
