Vitas-M small molecule compound
2-(4-chlorophenyl)-2-oxoethyl 6-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)hexanoate
Catalog ID
STK359324
SMILES O=C(OCC(=O)c1ccc(cc1)Cl)CCCCCN1C(=O)C2C(C1=O)C1C=CC2C2C1C2
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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 C25H26ClNO5 MW 455.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26ClNO5/c26-15-7-5-14(6-8-15)20(28)13-32-21(29)4-2-1-3-11-27-24(30)22-16-9-10-17(19-12-18(16)19)23(22)25(27)31/h5-10,16-19,22-23H,1-4,11-13H2InChIKey
XGJFWKHFKGYKQH-UHFFFAOYSA-NSynonyms
2(4chlorophenyl)2oxoethyl6(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)hexanoate
C1C2C1C3C=CC2C4C3C(=O)N(C4=O)CCCCCC(=O)OCC(=O)C5=CC=C(C=C5)Cl
InChI=1SC25H26ClNO5c26157514(6815)20(28)133221(29)4213112724(30)221691017(191218(16)19)23(22)25(27)31h51016192223H141113H2
MFCD02314588
ZINC000239433133
ZINC000239433136
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