Vitas-M small molecule compound
N-[(2S,3S)-1-hydroxy-3-methylpentan-2-yl]-2-{[(2Z)-2-(4-methoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetamide
Catalog ID
STL534948
SMILES OC[C@H]([C@H](CC)C)NC(=O)COc1ccc2c(c1)O/C(=C\c1ccc(cc1)OC)/C2=O
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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 C24H27NO6 MW 425.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27NO6/c1-4-15(2)20(13-26)25-23(27)14-30-18-9-10-19-21(12-18)31-22(24(19)28)11-16-5-7-17(29-3)8-6-16/h5-12,15,20,26H,4,13-14H2,1-3H3,(H,25,27)/b22-11-/t15-,20+/m0/s1InChIKey
XBSOMFHBXWLKPH-ZPQSMSLMSA-NSynonyms
956948-94-0~(N)((2~(S)3~(S))1hydroxy3methylpentan2yl)2(((2~(Z))2((4methoxyphenyl)methylidene)3oxo1benzofuran6yl)oxy)acetamide
16408068
956948940
InChI=1SC24H27NO6c1415(2)20(1326)2523(27)1430189101921(1218)3122(24(19)28)11165717(293)8616h512152026H41314H213H3(H2527)b2211t1520+m0s1
N((2S3S)1hydroxy3methylpentan2yl)2(((2Z)2(4methoxybenzylidene)3oxo23dihydro1benzofuran6yl)oxy)acetamide
N((2S3S)1hydroxy3methylpentan2yl)2(((Z)2(4methoxybenzylidene)3oxo23dihydrobenzofuran6yl)oxy)acetamide
OC(C@H)((C@H)(CC)C)NC(=O)COc1ccc2c(c1)OC(=Cc1ccc(cc1)OC)C2=O
ZINC000012893711
ZINC12893711
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