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Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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The Swiss Initiative in Systems Biology

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S-Methyl benzenecarbothioate

Properties

Image

Occurences in reactions

MNX_ID

MNXM114703

Image of MNXM114703

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

formula

C₈H₈OS

charge

0

mass

152.02959

reference

InChIKey

RQVWTMCUTHKGCM-UHFFFAOYSA-N

InChI

InChI=1S/C8H8OS/c1-10-8(9)7-5-3-2-4-6-7/h2-6H,1H3

SMILES

CSC(=O)c1ccccc1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:169501 chebi:169501	S-Methyl benzenecarbothioate S-methyl benzenecarbothioate
metacyc.compound:CPD-14756 metacycM:CPD-14756 seed.compound:cpd35487 seedM:cpd35487	(S)-methyl thiobenzoate S-ethyl benzothioate S-methyl benzenecarbothioate methylthiobenzoate methylthiobenzoic acid thiobenzoic acid methyl ester thiobenzoic acid methylthioester
hmdb:HMDB0029694	S-Methyl benzenecarbothioate (Methylsulphanyl)(phenyl)methanone (S)-Methyl thiobenzoate (methylsulfanyl)(phenyl)methanone Benzenecarbothioic acid, S-methyl ester Benzoic acid, thio-, S-methyl ester Methyl thiobenzoate S-Ethyl benzothioate S-Methyl benzenecarbothioic acid S-Methyl benzothioate S-Methyl thiobenzoate Thiobenzoic acid S-methyl ester
hmdb:HMDB29694 seedM:M_cpd35487	secondary/obsolete/fantasy identifier