Vitas-M small molecule compound
4-ethylphenyl 2-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)-3-phenylpropanoate
Catalog ID
STK359364
SMILES CCc1ccc(cc1)OC(=O)C(N1C(=O)C2C(C1=O)C1C=CC2C2C1C2)Cc1ccccc1
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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 C28H27NO4 MW 441.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27NO4/c1-2-16-8-10-18(11-9-16)33-28(32)23(14-17-6-4-3-5-7-17)29-26(30)24-19-12-13-20(22-15-21(19)22)25(24)27(29)31/h3-13,19-25H,2,14-15H2,1H3InChIKey
SIFNWVZFBSLBLO-UHFFFAOYSA-NSynonyms
4ethylphenyl2(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)3phenylpropanoate
CCC1=CC=C(C=C1)OC(=O)C(CC2=CC=CC=C2)N3C(=O)C4C5C=CC(C4C3=O)C6C5C6
InChI=1SC28H27NO4c121681018(11916)3328(32)23(14176435717)2926(30)2419121320(221521(19)22)25(24)27(29)31h3131925H21415H21H3
MFCD02314674
ZINC000239203402
ZINC000239203405
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