Vitas-M small molecule compound

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

Catalog ID
STK445139
SMILES O=C(C1C2C=CC(C1C(=O)O)O2)NC1CCCCCC1

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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 C15H21NO4 MW 279.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H21NO4/c17-14(16-9-5-3-1-2-4-6-9)12-10-7-8-11(20-10)13(12)15(18)19/h7-13H,1-6H2,(H,16,17)(H,18,19)
InChIKey
HYCFRKTXICJVPV-UHFFFAOYSA-N
Synonyms

2(CYCLOHEPTYLCARBAMOYL)7OXABICYCLO(221)HEPT5ENE3CARBOXYLICACID
3(cycloheptylcarbamoyl)7oxabicyclo(221)hept5ene2carboxylicacid
3(NCYCLOHEPTYLCARBAMOYL)7OXABICYCLO(221)HEPT5ENE2CARBOXYLICACID
C1CCCC(CC1)NC(=O)C2C3C=CC(C2C(=O)O)O3
InChI=1SC15H21NO4c1714(1695312469)12107811(2010)13(12)15(18)19h713H16H2(H1617)(H1819)
MFCD03383462
ZINC000225686288
ZINC000239309926

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Available files

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