Vitas-M small molecule compound
(2Z)-3-oxo-2-[4-(propan-2-yl)benzylidene]-2,3-dihydro-1-benzofuran-6-yl 1,3-benzodioxole-5-carboxylate
Catalog ID
STK923849
SMILES O=C1/C(=C/c2ccc(cc2)C(C)C)/Oc2c1ccc(c2)OC(=O)c1ccc2c(c1)OCO2
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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 C26H20O6 MW 428.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20O6/c1-15(2)17-5-3-16(4-6-17)11-24-25(27)20-9-8-19(13-22(20)32-24)31-26(28)18-7-10-21-23(12-18)30-14-29-21/h3-13,15H,14H2,1-2H3/b24-11-InChIKey
XTIVEQPQNORNQN-MYKKPKGFSA-NSynonyms
858754-37-7((2Z)3OXO2((4PROPAN2YLPHENYL)METHYLIDENE)1BENZOFURAN6YL)13BENZODIOXOLE5CARBOXYLATE
(2Z)3oxo2(4(propan2yl)benzylidene)23dihydro1benzofuran6yl13benzodioxole5carboxylate
(Z)2(4isopropylbenzylidene)3oxo23dihydrobenzofuran6ylbenzo(d)(13)dioxole5carboxylate
2((4(METHYLETHYL)PHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL2HBENZO(34D)13DIOXOLENE5CARBOXYLATE
858754377
CC(C)C1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC5=C(C=C4)OCO5
InChI=1SC26H20O6c115(2)175316(4617)112425(27)209819(1322(20)3224)3126(28)187102123(1218)30142921h31315H14H212H3b2411
MFCD04142305
O=C1C(=Cc2ccc(cc2)C(C)C)Oc2c1ccc(c2)OC(=O)c1ccc2c(c1)OCO2
ZINC000002096562
ZINC02096562
ZINC2096562
Check stock
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Check stock on Vitas-MAvailable files
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