Vitas-M small molecule compound
3,5-dimethylphenyl 3-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)propanoate
Catalog ID
STK258560
SMILES O=C(Oc1cc(C)cc(c1)C)CCN1C(=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 C22H23NO4 MW 365.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO4/c1-11-7-12(2)9-13(8-11)27-18(24)5-6-23-21(25)19-14-3-4-15(17-10-16(14)17)20(19)22(23)26/h3-4,7-9,14-17,19-20H,5-6,10H2,1-2H3InChIKey
FDKJSJGIAQCACZ-UHFFFAOYSA-NSynonyms
35dimethylphenyl3(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)propanoate
CC1=CC(=CC(=C1)OC(=O)CCN2C(=O)C3C4C=CC(C3C2=O)C5C4C5)C
InChI=1SC22H23NO4c111712(2)913(811)2718(24)562321(25)19143415(171016(14)17)20(19)22(23)26h347914171920H5610H212H3
MFCD03578072
ZINC000195338155
ZINC000239038916
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