Vitas-M small molecule compound

4-heptyl-1-[(6-methylpyridin-3-yl)ethynyl]cyclohexanol

Catalog ID
STK097589
SMILES CCCCCCCC1CCC(CC1)(O)C#Cc1ccc(nc1)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 C21H31NO MW 313.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H31NO/c1-3-4-5-6-7-8-19-11-14-21(23,15-12-19)16-13-20-10-9-18(2)22-17-20/h9-10,17,19,23H,3-8,11-12,14-15H2,1-2H3
InChIKey
GTUXZTRRCPXBTC-UHFFFAOYSA-N
Synonyms

4HEPTYL1((6METHYLPYRIDIN3YL)ETHYNYL)CYCLOHEXANOL
4HEPTYL1(2(6METHYLPYRIDIN3YL)ETHYNYL)CYCLOHEXAN1OL
CCCCCCCC1CCC(CC1)(C#CC2=CN=C(C=C2)C)O
CCCCCCCC1CCC(CC1)(O)C#Cc1ccc(nc1)C
InChI=1SC21H31NOc134567819111421(23151219)16132010918(2)221720h910171923H3811121415H212H3
MFCD01244959
STK097589
ZINC000097997924
ZINC97997924

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Available files

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