Glycoside
GD048799
Name:
NoneFormula:
C12H18O6N2SSmiles:
Cc1ncsc1CCNC(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)COAglycone:
Cc1ncsc1CCNSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -2.25 | Num_rotatable_bonds: | 8 |
| MolWt: | 318.35 | Num_heavy_atoms: | 21 |
| TPSA: | 139.98 | NumAromaticRings: | 1 |
Unique Aglycone
AD25976
Formula: C6H10N2S
Smiles:
Cc1ncsc1CCN| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 0.95 | Num_rotatable_bonds: | 2 |
| MolWt: | 142.23 | Num_heavy_atoms: | 9 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
