N-Formyl-3-sulfanylvaline
Basic information
- CAS
6335-66-6- Standard SMILES
CC(C)(S)C(NC=O)C(=O)O- InChIKey
ANCLDHSEMKEXLS-UHFFFAOYSA-N- Molecular formula
- C6H11NO3S
- Average molar mass
- 177.22 g/mol
- Monoisotopic mass
- 177.04596439
Names & identifiers
- Preferred name
- N-Formyl-3-sulfanylvaline
- IUPAC
- 2-formamido-3-methyl-3-sulfanylbutanoic acid
Names & synonyms
N-Formyl-3-sulfanylvaline6335-66-6DTXSID00325164RefChem:364070DTXCID80276281N-Formyl-3-mercaptovaline2-Formamido-3-mercapto-3-methylbutanoic acidN-Formyl-3-mercaptovaline; DL-Valine, N-formyl-3-mercapto-; NSC 28038; N-FormylpenicillaminNSC28038D-N-FORMYLPENICILLAMINEDL-Piperacillin EP Impurity ISCHEMBL6671092
Show more names
NSC-28038AKOS024332261Tazobactam Impurity B;Formyl penicillamine(USP)
Database identifiers
- CAS
6335-66-6- PubChem CID
- 349296
- DTXSID
DTXSID00325164
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 169
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Related reactions
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Compound notes
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