Glycoside
GD073333
Name:
NoneFormula:
C15H17O7N3SSmiles:
COc1ccc(-c2nnsc2NC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)cc1Aglycone:
COc1ccc(-c2nnsc2N)cc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -1.2 | Num_rotatable_bonds: | 8 |
| MolWt: | 383.38 | Num_heavy_atoms: | 26 |
| TPSA: | 162.1 | NumAromaticRings: | 2 |
Unique Aglycone
AD34018
Formula: C9H9ON3S
Smiles:
COc1ccc(-c2nnsc2N)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.11 |
| AlogP: | 1.8 | Num_rotatable_bonds: | 2 |
| MolWt: | 207.26 | Num_heavy_atoms: | 14 |
| TPSA: | 61.03 | NumAromaticRings: | 2 |
