Vitas-M small molecule compound

(2E,4E)-5-(dimethylamino)-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)penta-2,4-dien-1-one

Catalog ID
STK043000
SMILES CN(/C=C/C=C/C(=O)C12CC3CC(C2)CC(C1)C3)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 C17H25NO MW 259.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H25NO/c1-18(2)6-4-3-5-16(19)17-10-13-7-14(11-17)9-15(8-13)12-17/h3-6,13-15H,7-12H2,1-2H3/b5-3+,6-4+
InChIKey
DARKFYOPKDRZRN-GGWOSOGESA-N
Synonyms

(2E4E)1(1ADAMANTYL)5(DIMETHYLAMINO)PENTA24DIEN1ONE
(2E4E)5(dimethylamino)1(tricyclo(3311~37~)dec1yl)penta24dien1one
CN(C)C=CC=CC(=O)C12CC3CC(C1)CC(C3)C2
CN(C=CC=CC(=O)C12CC3CC(C2)CC(C1)C3)C
InChI=1SC17H25NOc118(2)643516(19)171013714(1117)915(813)1217h361315H712H212H3b53+64+
MFCD08050758
STK043000
ZINC000049992042
ZINC49992042

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Available files

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