Vitas-M small molecule compound
octyl beta-hydroxy-N-[(9-oxo-9H-fluoren-2-yl)sulfonyl]phenylalaninate
Catalog ID
STL325357
SMILES CCCCCCCCOC(=O)C(C(c1ccccc1)O)NS(=O)(=O)c1ccc2c(c1)C(=O)c1c2cccc1
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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 C30H33NO6S MW 535.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33NO6S/c1-2-3-4-5-6-12-19-37-30(34)27(28(32)21-13-8-7-9-14-21)31-38(35,36)22-17-18-24-23-15-10-11-16-25(23)29(33)26(24)20-22/h7-11,13-18,20,27-28,31-32H,2-6,12,19H2,1H3InChIKey
XOIHEMQFVXVZOZ-UHFFFAOYSA-NSynonyms
(2R3S)octyl3hydroxy2(9oxo9Hfluorene2sulfonamido)3phenylpropanoate
CCCCCCCCOC(=O)(C@@H)((C@H)(c1ccccc1)O)NS(=O)(=O)c1ccc2c(c1)C(=O)c1c2cccc1
CCCCCCCCOC(=O)C(C(C1=CC=CC=C1)O)NS(=O)(=O)C2=CC3=C(C=C2)C4=CC=CC=C4C3=O
InChI=1SC30H33NO6Sc12345612193730(34)27(28(32)21138791421)3138(3536)22171824231510111625(23)29(33)26(24)2022h71113182027283132H261219H21H3
MFCD01126951
OCTYL3HYDROXY2(((9OXO9HFLUOREN2YL)SULFONYL)AMINO)3PHENYLPROPANOATE
OCTYL3HYDROXY2((9OXOFLUOREN2YL)SULFONYLAMINO)3PHENYLPROPANOATE
octylbetahydroxyN((9oxo9Hfluoren2yl)sulfonyl)phenylalaninate
ZINC000008435384
ZINC000008435387
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