Vitas-M small molecule compound
(2S)-{[(2,2-dimethyltetrahydro-2H-pyran-4-yl)carbonyl]amino}(phenyl)ethanoic acid
Catalog ID
STL535178
SMILES OC(=O)[C@H](c1ccccc1)NC(=O)C1CCOC(C1)(C)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 C16H21NO4 MW 291.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21NO4/c1-16(2)10-12(8-9-21-16)14(18)17-13(15(19)20)11-6-4-3-5-7-11/h3-7,12-13H,8-10H2,1-2H3,(H,17,18)(H,19,20)/t12?,13-/m0/s1InChIKey
GBFYKOUNVPMQMK-ABLWVSNPSA-NSynonyms
956988-92-4(2~(S))2((22dimethyloxane4carbonyl)amino)2phenylaceticacid
(2S)(((22dimethyltetrahydro2Hpyran4yl)carbonyl)amino)(phenyl)ethanoicacid
(2S)2(22dimethyltetrahydro2Hpyran4carboxamido)2phenylaceticacid
16409636
956988924
InChI=1SC16H21NO4c116(2)1012(892116)14(18)1713(15(19)20)116435711h371213H810H212H3(H1718)(H1920)t12?13m0s1
MFCD09843298
OC(=O)(C@H)(c1ccccc1)NC(=O)C1CCOC(C1)(C)C
ZINC000012898297
ZINC000012898302
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