Vitas-M small molecule compound
4-propylphenyl 4-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)benzoate
Catalog ID
STK387185
SMILES CCCc1ccc(cc1)OC(=O)c1ccc(cc1)N1C(=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 C27H25NO4 MW 427.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25NO4/c1-2-3-15-4-10-18(11-5-15)32-27(31)16-6-8-17(9-7-16)28-25(29)23-19-12-13-20(22-14-21(19)22)24(23)26(28)30/h4-13,19-24H,2-3,14H2,1H3InChIKey
GZBMSJGLBGTBNB-UHFFFAOYSA-NSynonyms
4propylphenyl4(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)benzoate
CCCC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)N3C(=O)C4C5C=CC(C4C3=O)C6C5C6
InChI=1SC27H25NO4c1231541018(11515)3227(31)166817(9716)2825(29)2319121320(221421(19)22)24(23)26(28)30h4131924H2314H21H3
MFCD02314694
ZINC000239308791
ZINC000239308794
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