S-Methyl-cefmetazole

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H17N7O4S4
Molecular Weight	487.6
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12SCC(CSC3=NN=NN3C)=C(N1C(=O)[C@]2(NC(=O)CSCC#N)SC)C(O)=O

InChI

InChIKey=XWKWCPOCBYWASE-HIFRSBDPSA-N

InChI=1S/C15H17N7O4S4/c1-21-14(18-19-20-21)30-6-8-5-29-13-15(27-2,17-9(23)7-28-4-3-16)12(26)22(13)10(8)11(24)25/h13H,4-7H2,1-2H3,(H,17,23)(H,24,25)/t13-,15+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C15H17N7O4S4
Molecular Weight	487.6
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:54:56 UTC 2023` Edited by `admin` on `Sat Dec 16 19:54:56 UTC 2023`
Record UNII	Q2N6PEJ9HX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

S-Methyl-cefmetazole

Common Name

English

(6R,7S)-7-(2-((cyanomethyl)thio)acetamido)-3-(((1-methyl-1H-tetrazol-5-yl)methyl)thio)-7-(methylthio)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systematic Name

English

5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[[(cyanomethyl)thio]acetyl]amino]-3-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-7-(methylthio)-8-oxo-, (6R-cis)-

Systematic Name

English

Code System Code Type Description

FDA UNII

Q2N6PEJ9HX

Created by admin on Sat Dec 16 19:54:56 UTC 2023 , Edited by admin on Sat Dec 16 19:54:56 UTC 2023

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CAS

68576-47-6

Created by admin on Sat Dec 16 19:54:56 UTC 2023 , Edited by admin on Sat Dec 16 19:54:56 UTC 2023

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PUBCHEM

129010488

Created by admin on Sat Dec 16 19:54:56 UTC 2023 , Edited by admin on Sat Dec 16 19:54:56 UTC 2023

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