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Basic information
- CAS
116507-04-1- Standard SMILES
CO[C@H]1C(=O)N2C(C(=O)N3CCC[C@H]3C(=O)O)=C(COC(C)=O)CS(=O)(=O)[C@H]12- InChIKey
SMZXYXKZTNLAKY-ITDIGPHOSA-N- Molecular formula
- C16H20N2O9S
- Average molar mass
- 416.408 g/mol
- Monoisotopic mass
- 416.08895122
Names & identifiers
- Preferred name
- 1-{3-[(Acetyloxy)methyl]-7-methoxy-5,5,8-trioxo-5lambda~6~-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carbonyl}proline
- IUPAC
- 1-{(6R,7S)-3-[(Acetyloxy)methyl]-7-methoxy-5,5,8-trioxo-5lambda~6~-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carbonyl}-D-proline
- English name
- L 658758
- Molecular formula
- C16H20N2O9S
- Molecular weight
- 416.4
Names & synonyms
L658L 658L-658L 6587583-(Acetyloxymethyl)-4-[[(2S)-2-carboxypyrrolidin]-1-ylcarbonyl]-7α-methoxycepham-3-ene 1,1-dioxide(6R)-3-(Acetyloxymethyl)-7β-methoxy-8-oxo-2-[[(2S)-2-carboxypyrrolidin]-1-ylcarbonyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene 5,5-dioxide
Database identifiers
- CAS
116507-04-1- PubChem CID
- 121963
- DTXSID
DTXSID30922084- ChEMBL
CHEMBL446371- UNII
- YMN4MD1ZGQ
Properties
Physicochemical properties
- Boiling point
- 807.765 · 807.765±65.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.6 · 1.600±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 3.713 · 3.713±0.20(predicted)
- FDA UNII
- 4 MD1ZGQ · YMN4MD1ZGQ
Chemistry & industry
Applications
UsesL 658758 is a potent inhibitor of serine proteinase[1].
Suppliers3 total
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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