Vitas-M small molecule compound
(2Z)-2-[(2E)-3-(2-methoxyphenyl)prop-2-en-1-ylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 1,3-benzodioxole-5-carboxylate
Catalog ID
STK924681
SMILES COc1ccccc1/C=C/C=C/1\Oc2c(C1=O)ccc(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 C26H18O7 MW 442.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18O7/c1-29-20-7-3-2-5-16(20)6-4-8-22-25(27)19-11-10-18(14-23(19)33-22)32-26(28)17-9-12-21-24(13-17)31-15-30-21/h2-14H,15H2,1H3/b6-4+,22-8-InChIKey
ODMILIWOBBXECQ-WDJNEDGGSA-NSynonyms
622801-68-7((2Z)2((E)3(2METHOXYPHENYL)PROP2ENYLIDENE)3OXO1BENZOFURAN6YL)13BENZODIOXOLE5CARBOXYLATE
(2Z)2((2E)3(2methoxyphenyl)prop2en1ylidene)3oxo23dihydro1benzofuran6yl13benzodioxole5carboxylate
(Z)2((E)3(2methoxyphenyl)allylidene)3oxo23dihydrobenzofuran6ylbenzo(d)(13)dioxole5carboxylate
2((2E)3(2METHOXYPHENYL)PROP2ENYLIDENE)3OXOBENZO(34B)FURAN6YL2HBENZO(34D)13DIOXOLENE5CARBOXYLATE
622801687
COC1=CC=CC=C1C=CC=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC5=C(C=C4)OCO5
COc1ccccc1C=CC=C1Oc2c(C1=O)ccc(c2)OC(=O)c1ccc2c(c1)OCO2
InChI=1SC26H18O7c12920732516(20)6482225(27)19111018(1423(19)3322)3226(28)179122124(1317)31153021h214H15H21H3b64+228
MFCD04145924
ZINC000002104605
ZINC02104605
ZINC2104605
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