Vitas-M small molecule compound
(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl cyclohexanecarboxylate
Catalog ID
STK618632
SMILES O=C(C1CCCCC1)Oc1ccc2c(c1)O/C(=C\c1ccc3c(c1)OCO3)/C2=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 C23H20O6 MW 392.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20O6/c24-22-17-8-7-16(28-23(25)15-4-2-1-3-5-15)12-19(17)29-21(22)11-14-6-9-18-20(10-14)27-13-26-18/h6-12,15H,1-5,13H2/b21-11-InChIKey
YBCQVDAKLADXRV-NHDPSOOVSA-NSynonyms
929429-24-3((2Z)2(13benzodioxol5ylmethylidene)3oxo1benzofuran6yl)cyclohexanecarboxylate
(2Z)2(13benzodioxol5ylmethylidene)3oxo23dihydro1benzofuran6ylcyclohexanecarboxylate
(Z)2(benzo(d)(13)dioxol5ylmethylene)3oxo23dihydrobenzofuran6ylcyclohexanecarboxylate
2(2HBENZO(34D)13DIOXOLAN5YLMETHYLENE)3OXOBENZO(34B)FURAN6YLCYCLOHEXANECARBOXYLATE
929429243
C1CCC(CC1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC5=C(C=C4)OCO5)O3
InChI=1SC23H20O6c2422178716(2823(25)154213515)1219(17)2921(22)1114691820(1014)27132618h61215H1513H2b2111
MFCD08745161
O=C(C1CCCCC1)Oc1ccc2c(c1)OC(=Cc1ccc3c(c1)OCO3)C2=O
ZINC000009183727
ZINC09183727
ZINC9183727
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