Vitas-M small molecule compound

2,2'-(3-methylbutane-1,1-diyl)bis(3-hydroxycyclohex-2-en-1-one)

Catalog ID
STK723404
SMILES CC(CC(C1=C(O)CCCC1=O)C1=C(O)CCCC1=O)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 C17H24O4 MW 292.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H24O4/c1-10(2)9-11(16-12(18)5-3-6-13(16)19)17-14(20)7-4-8-15(17)21/h10-11,18,20H,3-9H2,1-2H3
InChIKey
RAZSTLIPGVZKEL-UHFFFAOYSA-N
Synonyms

22(3methylbutane11diyl)bis(3hydroxycyclohex2en1one)
3HYDROXY2(1(2HYDROXY6OXOCYCLOHEXEN1YL)3METHYLBUTYL)CYCLOHEX2EN1ONE
3HYDROXY2(1(6HYDROXY2OXOCYCLOHEX1(6)ENYL)3METHYLBUTYL)CYCLOHEX2EN1ONE
CC(C)CC(C1=C(CCCC1=O)O)C2=C(CCCC2=O)O
InChI=1SC17H24O4c110(2)911(1612(18)53613(16)19)1714(20)74815(17)21h10111820H39H212H3
MFCD00472663
ZINC000004381042
ZINC04381042
ZINC4381042

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Available files

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