Vitas-M small molecule compound

3,4-dimethyl-6-(pentylcarbamoyl)cyclohex-3-ene-1-carboxylic acid

Catalog ID
STK426248
SMILES CCCCCNC(=O)C1CC(=C(CC1C(=O)O)C)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 C15H25NO3 MW 267.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H25NO3/c1-4-5-6-7-16-14(17)12-8-10(2)11(3)9-13(12)15(18)19/h12-13H,4-9H2,1-3H3,(H,16,17)(H,18,19)
InChIKey
NJAPKPKANSMAPV-UHFFFAOYSA-N
Synonyms

(1R6R)34DIMETHYL6(PENTYLCARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
(1S6S)34DIMETHYL6(PENTYLCARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
34DIMETHYL6(NPENTYLCARBAMOYL)CYCLOHEX3ENECARBOXYLICACID
34dimethyl6(pentylcarbamoyl)cyclohex3ene1carboxylicacid
InChI=1SC15H25NO3c145671614(17)12810(2)11(3)913(12)15(18)19h1213H49H213H3(H1617)(H1819)
MFCD02608945
ZINC000002109197
ZINC000004180354

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.