Vitas-M small molecule compound

3-methyl-5-{[(5-methylfuran-2-yl)methyl]amino}-5-oxopentanoic acid

Catalog ID
STK215316
SMILES CC(CC(=O)O)CC(=O)NCc1ccc(o1)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 C12H17NO4 MW 239.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H17NO4/c1-8(6-12(15)16)5-11(14)13-7-10-4-3-9(2)17-10/h3-4,8H,5-7H2,1-2H3,(H,13,14)(H,15,16)
InChIKey
ZNKIGPITZKIXCO-UHFFFAOYSA-N
Synonyms

3METHYL5(((5METHYL2FURYL)METHYL)AMINO)5OXOPENTANOICACID
3METHYL5(((5METHYLFURAN2YL)METHYL)AMINO)5OXOPENTANOICACID
3methyl5((5methylfuran2yl)methylamino)5oxopentanoicacid
CC1=CC=C(O1)CNC(=O)CC(C)CC(=O)O
InChI=1SC12H17NO4c18(612(15)16)511(14)13710439(2)1710h348H57H212H3(H1314)(H1516)
MFCD08673468
ZINC000004784802
ZINC000004784804

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Available files

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