Vitas-M small molecule compound
(3E)-3-(methoxycarbonyl)-4-(4-methoxyphenyl)but-3-enoic acid
Catalog ID
STK695543
SMILES COc1ccc(cc1)/C=C(/C(=O)OC)\CC(=O)O
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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 C13H14O5 MW 250.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14O5/c1-17-11-5-3-9(4-6-11)7-10(8-12(14)15)13(16)18-2/h3-7H,8H2,1-2H3,(H,14,15)/b10-7+InChIKey
JCZVRPGUXODGAO-JXMROGBWSA-NSynonyms
86017-93-8(3E)3(methoxycarbonyl)4(4methoxyphenyl)but3enoicacid
(E)3METHOXYCARBONYL4(4METHOXYPHENYL)BUT3ENOICACID
2(4METHOXYBENZYLIDENE)SUCCINICACID1METHYLESTER
3(METHOXYCARBONYL)4(4METHOXYPHENYL)BUT3ENOICACID
86017938
COC1=CC=C(C=C1)C=C(CC(=O)O)C(=O)OC
COc1ccc(cc1)C=C(C(=O)OC)CC(=O)O
InChI=1SC13H14O5c11711539(4611)710(812(14)15)13(16)182h37H8H212H3(H1415)b107+
MFCD18075372
ZINC000017022415
ZINC17022415
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