Vitas-M small molecule compound

3-(dipentylcarbamoyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid

Catalog ID
STK453442
SMILES CCCCCN(C(=O)C1C2CCC(C1C(=O)O)O2)CCCCC

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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 C18H31NO4 MW 325.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H31NO4/c1-3-5-7-11-19(12-8-6-4-2)17(20)15-13-9-10-14(23-13)16(15)18(21)22/h13-16H,3-12H2,1-2H3,(H,21,22)
InChIKey
HVCLRHYUTXIILF-UHFFFAOYSA-N
Synonyms

2(DIPENTYLCARBAMOYL)7OXABICYCLO(221)HEPTANE3CARBOXYLICACID
3(dipentylcarbamoyl)7oxabicyclo(221)heptane2carboxylicacid
3(NNDIPENTYLCARBAMOYL)7OXABICYCLO(221)HEPTANE2CARBOXYLICACID
CCCCCN(CCCCC)C(=O)C1C2CCC(C1C(=O)O)O2
InChI=1SC18H31NO4c13571119(128642)17(20)151391014(2313)16(15)18(21)22h1316H312H212H3(H2122)
MFCD03759278
ZINC000225708709
ZINC000239309750

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Available files

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