Vitas-M small molecule compound
4-(2-methylbutan-2-yl)phenyl 3-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)propanoate
Catalog ID
STK286545
SMILES CCC(c1ccc(cc1)OC(=O)CCN1C(=O)C2C(C1=O)C1C=CC2C2C1C2)(C)C
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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 C25H29NO4 MW 407.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29NO4/c1-4-25(2,3)14-5-7-15(8-6-14)30-20(27)11-12-26-23(28)21-16-9-10-17(19-13-18(16)19)22(21)24(26)29/h5-10,16-19,21-22H,4,11-13H2,1-3H3InChIKey
SJRYELQMMMOVLI-UHFFFAOYSA-NSynonyms
4(2METHYLBUTAN2YL)PHENYL3((3AR4R4AS5AR6S6AS)13DIOXOOCTAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOL2(1H)YL)PROPANOATE
4(2methylbutan2yl)phenyl3(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)propanoate
CCC(C)(C)C1=CC=C(C=C1)OC(=O)CCN2C(=O)C3C4C=CC(C3C2=O)C5C4C5
InChI=1SC25H29NO4c1425(23)145715(8614)3020(27)11122623(28)211691017(191318(16)19)22(21)24(26)29h51016192122H41113H213H3
MFCD03578077
ZINC000239203436
ZINC000239203439
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