Vitas-M small molecule compound
Catalog ID
STK691814
SMILES OC(=O)C1=NOC(C1)(C)[C@H]1CC=C(C(=O)C1)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 C12H15NO4 MW 237.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15NO4/c1-7-3-4-8(5-10(7)14)12(2)6-9(11(15)16)13-17-12/h3,8H,4-6H2,1-2H3,(H,15,16)/t8-,12?/m0/s1InChIKey
YDCLGBQQQCVZIB-KBPLZSHQSA-NSynonyms
1013759-72-2(5R)5((1S)4METHYL3OXOCYCLOHEX4ENYL)5METHYL45DIHYDROISOXAZOLE3CARBOXYLICACID
1013759722
5methyl5((1S)4methyl5oxocyclohex3en1yl)4H12oxazole3carboxylicacid
CC1=CCC(CC1=O)C2(CC(=NO2)C(=O)O)C
InChI=1SC12H15NO4c17348(510(7)14)12(2)69(11(15)16)131712h38H46H212H3(H1516)t812?m0s1
OC(=O)C1=NOC(C1)(C)(C@H)1CC=C(C(=O)C1)C
ZINC000012416787
ZINC000012416789
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.