Vitas-M small molecule compound
6-{(3E)-2-(3,4-dimethoxyphenyl)-3-[hydroxy(phenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}hexanoic acid
Catalog ID
STK560385
SMILES COc1cc(ccc1OC)C1N(CCCCCC(=O)O)C(=O)C(=O)/C/1=C(\c1ccccc1)/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 C25H27NO7 MW 453.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO7/c1-32-18-13-12-17(15-19(18)33-2)22-21(23(29)16-9-5-3-6-10-16)24(30)25(31)26(22)14-8-4-7-11-20(27)28/h3,5-6,9-10,12-13,15,22,29H,4,7-8,11,14H2,1-2H3,(H,27,28)/b23-21+InChIKey
YPJLFXJZYHBSQG-XTQSDGFTSA-NSynonyms
332394-61-3332394613
6((3E)2(34dimethoxyphenyl)3(hydroxy(phenyl)methylidene)45dioxopyrrolidin1yl)hexanoicacid
COC1=C(C=C(C=C1)C2C(=C(C3=CC=CC=C3)O)C(=O)C(=O)N2CCCCCC(=O)O)OC
COc1cc(ccc1OC)C1N(CCCCCC(=O)O)C(=O)C(=O)C1=C(c1ccccc1)O
InChI=1SC25H27NO7c13218131217(1519(18)332)2221(23(29)1695361016)24(30)25(31)26(22)148471120(27)28h3569101213152229H4781114H212H3(H2728)b2321+
MFCD03818447
ZINC000102495538
ZINC000102495546
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