Vitas-M small molecule compound
6-[(1E)-3-cyclopropyl-3-oxoprop-1-en-1-yl]-2,3-dimethoxybenzoic acid
Catalog ID
STK530475
SMILES COc1c(OC)ccc(c1C(=O)O)/C=C/C(=O)C1CC1
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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 C15H16O5 MW 276.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16O5/c1-19-12-8-6-10(5-7-11(16)9-3-4-9)13(15(17)18)14(12)20-2/h5-9H,3-4H2,1-2H3,(H,17,18)/b7-5+InChIKey
GQMPHYSRLUDIGX-FNORWQNLSA-NSynonyms
(E)6(3cyclopropyl3oxoprop1en1yl)23dimethoxybenzoicacid
6((1E)3cyclopropyl3oxoprop1en1yl)23dimethoxybenzoicacid
6((E)3CYCLOPROPYL3OXOPROP1ENYL)23DIMETHOXYBENZOICACID
COC1=C(C(=C(C=C1)C=CC(=O)C2CC2)C(=O)O)OC
COc1c(OC)ccc(c1C(=O)O)C=CC(=O)C1CC1
InChI=1SC15H16O5c119128610(5711(16)9349)13(15(17)18)14(12)202h59H34H212H3(H1718)b75+
MFCD01547285
ZINC000004863036
ZINC4863036
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