Vitas-M small molecule compound
(2E)-4-(cyclooctylamino)-2-methyl-4-oxobut-2-enoic acid
Catalog ID
STK427527
SMILES O=C(/C=C(/C(=O)O)\C)NC1CCCCCCC1
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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 C13H21NO3 MW 239.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H21NO3/c1-10(13(16)17)9-12(15)14-11-7-5-3-2-4-6-8-11/h9,11H,2-8H2,1H3,(H,14,15)(H,16,17)/b10-9+InChIKey
SXGCBFNGASPVOI-MDZDMXLPSA-NSynonyms
(2E)3(NCYCLOOCTYLCARBAMOYL)2METHYLPROP2ENOICACID
(2E)4(cyclooctylamino)2methyl4oxobut2enoicacid
(E)4(CYCLOOCTYLAMINO)2METHYL4OXOBUT2ENOICACID
CC(=CC(=O)NC1CCCCCCC1)C(=O)O
InChI=1SC13H21NO3c110(13(16)17)912(15)1411753246811h911H28H21H3(H1415)(H1617)b109+
MFCD02612495
O=C(C=C(C(=O)O)C)NC1CCCCCCC1
ZINC000005516733
ZINC5516733
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