Vitas-M small molecule compound

4,7,7-trimethyl-1-[(2-methylpiperidin-1-yl)carbonyl]-2-oxabicyclo[2.2.1]heptan-3-one

Catalog ID
STK967884
SMILES CC1CCCCN1C(=O)C12CCC(C2(C)C)(C(=O)O1)C

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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 C16H25NO3 MW 279.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H25NO3/c1-11-7-5-6-10-17(11)12(18)16-9-8-15(4,13(19)20-16)14(16,2)3/h11H,5-10H2,1-4H3
InChIKey
XJKPZBQMOYTSPX-UHFFFAOYSA-N
Synonyms

(1R4S)477trimethyl1(2methylpiperidine1carbonyl)2oxabicyclo(221)heptan3one
177TRIMETHYL4((2METHYLPIPERIDYL)CARBONYL)3OXABICYCLO(221)HEPTAN2ONE
177TRIMETHYL4(2METHYLPIPERIDINE1CARBONYL)3OXABICYCLO(221)HEPTAN2ONE
477TRIMETHYL1((2METHYLPIPERIDIN1YL)CARBONYL)2OXABICYCLO(221)HEPTAN3ONE
CC1CCCCN1C(=O)C23CCC(C2(C)C)(C(=O)O3)C
InChI=1SC16H25NO3c1117561017(11)12(18)169815(413(19)2016)14(162)3h11H510H214H3
MFCD03147054
ZINC000005912204
ZINC000005954712

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Available files

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