Vitas-M small molecule compound
6-[(6-methyl-1,3-benzodioxol-5-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK665178
SMILES Cc1cc2OCOc2cc1NC(=O)C1CC=CCC1C(=O)O
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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 C16H17NO5 MW 303.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17NO5/c1-9-6-13-14(22-8-21-13)7-12(9)17-15(18)10-4-2-3-5-11(10)16(19)20/h2-3,6-7,10-11H,4-5,8H2,1H3,(H,17,18)(H,19,20)InChIKey
JZOMYLSRHYPZRD-UHFFFAOYSA-NSynonyms
6(((6METHYL13BENZODIOXOL5YL)AMINO)CARBONYL)3CYCLOHEXENE1CARBOXYLICACID
6((6methyl13benzodioxol5yl)carbamoyl)cyclohex3ene1carboxylicacid
CC1=CC2=C(C=C1NC(=O)C3CC=CCC3C(=O)O)OCO2
InChI=1SC16H17NO5c1961314(2282113)712(9)1715(18)10423511(10)16(19)20h23671011H458H21H3(H1718)(H1920)
MFCD08142301
ZINC000006668243
ZINC000006668246
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