Vitas-M small molecule compound

azepan-1-yl(3a,6a-dimethylhexahydro-1H-1,4-methanocyclopenta[c]furan-1-yl)methanone

Catalog ID
STK976298
SMILES O=C(C12OCC3(C2(C)CCC3C1)C)N1CCCCCC1

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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 C17H27NO2 MW 277.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H27NO2/c1-15-12-20-17(11-13(15)7-8-16(15,17)2)14(19)18-9-5-3-4-6-10-18/h13H,3-12H2,1-2H3
InChIKey
NCEAMTYRKKLCDM-UHFFFAOYSA-N
Synonyms

azepan1yl((1S3aS6aR)3a6adimethylhexahydro1H14methanocyclopenta(c)furan1yl)methanone
AZEPAN1YL(3A6ADIMETHYLHEXAHYDRO1H14METHANOCYCLOPENTA(C)FURAN1YL)METHANONE
CC12CCC3C1(COC2(C3)C(=O)N4CCCCCC4)C
InChI=1SC17H27NO2c115122017(1113(15)7816(1517)2)14(19)18953461018h13H312H212H3
MFCD02167779
O=C((C@)12OC(C@@)3(C2(C)CCC3C1)C)N1CCCCCC1
ZINC000197913102

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Available files

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