Vitas-M small molecule compound

[5-methyl-1-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]oct-4-yl]methyl acetate

Catalog ID
STK049866
SMILES CC(=O)OCC12CCC(OC1)(CC2C)CCC=C(C)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 C17H28O3 MW 280.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H28O3/c1-13(2)6-5-7-17-9-8-16(12-20-17,14(3)10-17)11-19-15(4)18/h6,14H,5,7-12H2,1-4H3
InChIKey
AXJOCLMFQAZKPU-UHFFFAOYSA-N
Synonyms

((1S4S)5methyl1(4methylpent3en1yl)2oxabicyclo(222)octan4yl)methylacetate
(5METHYL1(4METHYLPENT3EN1YL)2OXABICYCLO(222)OCT4YL)METHYLACETATE
(5METHYL1(4METHYLPENT3ENYL)2OXABICYCLO(222)OCTAN4YL)METHYLACETATE
CC(=O)OC(C@)12CC(C@)(OC1)(CC2C)CCC=C(C)C
CC(=O)OCC12CCC(OC1)(CC2C)CCC=C(C)C
CC1CC2(CCC1(CO2)COC(=O)C)CCC=C(C)C
InChI=1SC17H28O3c113(2)657179816(12201714(3)1017)111915(4)18h614H5712H214H3
MFCD01004083
STK049866
ZINC000000485593
ZINC000000485594

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Available files

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