Vitas-M small molecule compound

3-(piperidin-1-ylcarbonyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid

Catalog ID
STK443349
SMILES OC(=O)C1C2C=CC(C1C(=O)N1CCCCC1)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 C13H17NO4 MW 251.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17NO4/c15-12(14-6-2-1-3-7-14)10-8-4-5-9(18-8)11(10)13(16)17/h4-5,8-11H,1-3,6-7H2,(H,16,17)
InChIKey
WDBSFMAGIDPLAF-UHFFFAOYSA-N
Synonyms

2(PIPERIDINE1CARBONYL)7OXABICYCLO(221)HEPT5ENE3CARBOXYLICACID
3(piperidin1ylcarbonyl)7oxabicyclo(221)hept5ene2carboxylicacid
3(PIPERIDYLCARBONYL)7OXABICYCLO(221)HEPT5ENE2CARBOXYLICACID
C1CCN(CC1)C(=O)C2C3C=CC(C2C(=O)O)O3
InChI=1SC13H17NO4c1512(146213714)108459(188)11(10)13(16)17h45811H1367H2(H1617)
MFCD00584389
ZINC000225681372
ZINC000239235532

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Available files

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