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Butylmercaptomethylpenicillin

HCID 201537
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Basic information

CAS
6192-29-6
Standard SMILES
CCCCSCC(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O
InChIKey
AMZJKFHHVQNUPT-JFGNBEQYSA-N
Molecular formula
C14H22N2O4S2
Average molar mass
346.474 g/mol
Monoisotopic mass
346.10209918

Names & identifiers

Preferred name
Butylmercaptomethylpenicillin
IUPAC
(2S,5R,6R)-6-[2-(Butylsulfanyl)acetamido]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
English name
penicillin BT
Molecular formula
C14H22N2O4S2
Molecular weight
346.47

Names & synonyms

penicillin BT6α-[(Butylthio)acetyl]aminopenicillanic acid4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[2-(butylthio)acetyl]amino]-3,3-dimethyl-7-oxo-, (2S,5R,6R)-

Database identifiers

CAS
6192-29-6
PubChem CID
201537
DTXSID
DTXSID50210950
Nikkaji
J15.716C

Properties

Physicochemical properties

Density
1.2869 · 1.2869 (rough estimate)
refractive index
1.651 · 1.6510 (estimate)

Related reactions

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Compound notes

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