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Vitas-M small molecule compound

3-(azepan-1-ylcarbonyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid

Catalog ID
STL504341
SMILES OC(=O)C1C2CCC(C1C(=O)N1CCCCCC1)C=C2

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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 C16H23NO3 MW 277.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23NO3/c18-15(17-9-3-1-2-4-10-17)13-11-5-7-12(8-6-11)14(13)16(19)20/h5,7,11-14H,1-4,6,8-10H2,(H,19,20)
InChIKey
TVFBUFUYEFLRFN-UHFFFAOYSA-N
Synonyms

17379090
3(AZAPERHYDROEPINYLCARBONYL)BICYCLO(222)OCT5ENE2CARBOXYLICACID
3(azepan1ylcarbonyl)bicyclo(222)oct5ene2carboxylicacid
3(azepane1carbonyl)bicyclo(222)oct5ene2carboxylicacid
InChI=1SC16H23NO3c1815(17931241017)13115712(8611)14(13)16(19)20h571114H146810H2(H1920)
MFCD06066312
ZINC000101518887
ZINC000247427623

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Available files

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