Vitas-M small molecule compound

3-(cyclopropylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid

Catalog ID
STK454275
SMILES O=C(C1C2C=CC(C1C(=O)O)O2)NC1CC1

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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 C11H13NO4 MW 223.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H13NO4/c13-10(12-5-1-2-5)8-6-3-4-7(16-6)9(8)11(14)15/h3-9H,1-2H2,(H,12,13)(H,14,15)
InChIKey
DQTCZGVOCGKTTA-UHFFFAOYSA-N
Synonyms

2(CYCLOPROPYLCARBAMOYL)7OXABICYCLO(221)HEPT5ENE3CARBOXYLICACID
3(cyclopropylcarbamoyl)7oxabicyclo(221)hept5ene2carboxylicacid
3(NCYCLOPROPYLCARBAMOYL)7OXABICYCLO(221)HEPT5ENE2CARBOXYLICACID
C1CC1NC(=O)C2C3C=CC(C2C(=O)O)O3
InChI=1SC11H13NO4c1310(125125)86347(166)9(8)11(14)15h39H12H2(H1213)(H1415)
MFCD03377387
ZINC000225712097
ZINC000239038674

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Available files

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