Vitas-M small molecule compound
octyl beta-hydroxy-N-(naphthalen-2-ylsulfonyl)phenylalaninate
Catalog ID
STL326441
SMILES CCCCCCCCOC(=O)C(C(c1ccccc1)O)NS(=O)(=O)c1ccc2c(c1)cccc2
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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 C27H33NO5S MW 483.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33NO5S/c1-2-3-4-5-6-12-19-33-27(30)25(26(29)22-14-8-7-9-15-22)28-34(31,32)24-18-17-21-13-10-11-16-23(21)20-24/h7-11,13-18,20,25-26,28-29H,2-6,12,19H2,1H3InChIKey
YMVWORYGRSZHAY-UHFFFAOYSA-NSynonyms
(2R3S)octyl3hydroxy2(naphthalene2sulfonamido)3phenylpropanoate
CCCCCCCCOC(=O)(C@@H)((C@H)(c1ccccc1)O)NS(=O)(=O)c1ccc2c(c1)cccc2
CCCCCCCCOC(=O)C(C(C1=CC=CC=C1)O)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2
InChI=1SC27H33NO5Sc12345612193327(30)25(26(29)22148791522)2834(3132)241817211310111623(21)2024h71113182025262829H261219H21H3
MFCD01126942
OCTYL3HYDROXY2(NAPHTHALEN2YLSULFONYLAMINO)3PHENYLPROPANOATE
octylbetahydroxyN(naphthalen2ylsulfonyl)phenylalaninate
ZINC000100708221
ZINC000101362849
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