Vitas-M small molecule compound
3-(butylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STK430293
SMILES CCCCNC(=O)C1C2C=CC(C1C(=O)O)O2
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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 C12H17NO4 MW 239.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H17NO4/c1-2-3-6-13-11(14)9-7-4-5-8(17-7)10(9)12(15)16/h4-5,7-10H,2-3,6H2,1H3,(H,13,14)(H,15,16)InChIKey
SFKAVQDTLBPTMF-UHFFFAOYSA-NSynonyms
2(BUTYLCARBAMOYL)7OXABICYCLO(221)HEPT5ENE3CARBOXYLICACID
3((BUTYLAMINO)CARBONYL)7OXABICYCLO(221)HEPT5ENE2CARBOXYLICACID
3(butylcarbamoyl)7oxabicyclo(221)hept5ene2carboxylicacid
3(NBUTYLCARBAMOYL)7OXABICYCLO(221)HEPT5ENE2CARBOXYLICACID
7OXABICYCLO(221)HEPT5ENE2CARBOXYLICACID3((BUTYLAMINO)CARBONYL)
InChI=1SC12H17NO4c12361311(14)97458(177)10(9)12(15)16h45710H236H21H3(H1314)(H1516)
MFCD01336130
ZINC000105072267
ZINC000239203366
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