Vitas-M small molecule compound
2-(4-methoxyphenyl)-2-oxoethyl 2-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)hexanoate
Catalog ID
STK381112
SMILES CCCCC(N1C(=O)C2C(C1=O)C1C=CC2C2C1C2)C(=O)OCC(=O)c1ccc(cc1)OC
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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 C26H29NO6 MW 451.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29NO6/c1-3-4-5-20(26(31)33-13-21(28)14-6-8-15(32-2)9-7-14)27-24(29)22-16-10-11-17(19-12-18(16)19)23(22)25(27)30/h6-11,16-20,22-23H,3-5,12-13H2,1-2H3InChIKey
QZGASFHHGGCKLT-UHFFFAOYSA-NSynonyms
2(4methoxyphenyl)2oxoethyl2(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)hexanoate
CCCCC(C(=O)OCC(=O)C1=CC=C(C=C1)OC)N2C(=O)C3C4C=CC(C3C2=O)C5C4C5
InChI=1SC26H29NO6c134520(26(31)331321(28)146815(322)9714)2724(29)2216101117(191218(16)19)23(22)25(27)30h61116202223H351213H212H3
MFCD02189128
ZINC000239184789
ZINC000239184792
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