Vitas-M small molecule compound
2-(4-methoxyphenyl)-2-oxoethyl (1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)acetate
Catalog ID
STK269989
SMILES COc1ccc(cc1)C(=O)COC(=O)CN1C(=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 C22H21NO6 MW 395.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO6/c1-28-12-4-2-11(3-5-12)17(24)10-29-18(25)9-23-21(26)19-13-6-7-14(16-8-15(13)16)20(19)22(23)27/h2-7,13-16,19-20H,8-10H2,1H3InChIKey
OQVACCQQLSQPAS-UHFFFAOYSA-NSynonyms
2(4METHOXYPHENYL)2OXOETHYL((3AR4S4AR5AS6R6AS)13DIOXOOCTAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOL2(1H)YL)ACETATE
2(4methoxyphenyl)2oxoethyl(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)acetate
2(4methoxyphenyl)2oxoethyl2(13dioxo33a44a55a66aoctahydro46ethenocyclopropa(f)isoindol2(1H)yl)acetate
COC1=CC=C(C=C1)C(=O)COC(=O)CN2C(=O)C3C4C=CC(C3C2=O)C5C4C5
InChI=1SC22H21NO6c128124211(3512)17(24)102918(25)92321(26)19136714(16815(13)16)20(19)22(23)27h2713161920H810H21H3
MFCD02189064
ZINC000195222722
ZINC000239173791
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