Vitas-M small molecule compound
3-[(5-acetyl-2-methoxybenzyl)sulfanyl]propanoic acid
Catalog ID
STK967091
SMILES COc1ccc(cc1CSCCC(=O)O)C(=O)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C13H16O4S MW 268.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16O4S/c1-9(14)10-3-4-12(17-2)11(7-10)8-18-6-5-13(15)16/h3-4,7H,5-6,8H2,1-2H3,(H,15,16)InChIKey
FCXJUMVAVIWORZ-UHFFFAOYSA-NSynonyms
500200-91-93((5acetyl2methoxybenzyl)sulfanyl)propanoicacid
3((5acetyl2methoxybenzyl)thio)propanoicacid
3((5ACETYL2METHOXYPHENYL)METHYLSULFANYL)PROPANOICACID
500200919
CC(=O)C1=CC(=C(C=C1)OC)CSCCC(=O)O
InChI=1SC13H16O4Sc19(14)103412(172)11(710)8186513(15)16h347H568H212H3(H1516)
MFCD03666473
ZINC000004327080
ZINC4327080
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