Vitas-M small molecule compound
methyl 5-[(2E)-3-(furan-2-yl)prop-2-enoyl]-2,2-dimethyl-4,6-dioxocyclohexanecarboxylate
Catalog ID
STL525818
SMILES COC(=O)C1C(=O)C(C(=O)/C=C/c2ccco2)C(=O)CC1(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 C17H18O6 MW 318.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18O6/c1-17(2)9-12(19)13(15(20)14(17)16(21)22-3)11(18)7-6-10-5-4-8-23-10/h4-8,13-14H,9H2,1-3H3/b7-6+InChIKey
OZNNWTQYFYFKJQ-VOTSOKGWSA-NSynonyms
(E)methyl5(3(furan2yl)acryloyl)22dimethyl46dioxocyclohexanecarboxylate
5718926
COC(=O)C1C(=O)C(C(=O)C=Cc2ccco2)C(=O)CC1(C)C
InChI=1SC17H18O6c117(2)912(19)13(15(20)14(17)16(21)223)11(18)76105482310h481314H9H213H3b76+
methyl5((~(E))3(furan2yl)prop2enoyl)22dimethyl46dioxocyclohexane1carboxylate
METHYL5((2E)3(2FURYL)PROP2ENOYL)22DIMETHYL46DIOXOCYCLOHEXANECARBOXYLATE
methyl5((2E)3(furan2yl)prop2enoyl)22dimethyl46dioxocyclohexanecarboxylate
METHYL5((E)3(FURAN2YL)PROP2ENOYL)22DIMETHYL46DIOXOCYCLOHEXANE1CARBOXYLATE
MFCD00513051
ZINC000100150825
ZINC000100150829
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