Vitas-M small molecule compound

(2E,4E)-4-(2,4-dimethoxybenzylidene)-3-methylpent-2-enedioic acid

Catalog ID
STL512861
SMILES COc1cc(OC)ccc1/C=C(\C(=C\C(=O)O)\C)/C(=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 C15H16O6 MW 292.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16O6/c1-9(6-14(16)17)12(15(18)19)7-10-4-5-11(20-2)8-13(10)21-3/h4-8H,1-3H3,(H,16,17)(H,18,19)/b9-6+,12-7+
InChIKey
DDCHAXVNNPMCHJ-QBXHZEQXSA-N
Synonyms
374699-37-3
(~(E)4~(E))4((24dimethoxyphenyl)methylidene)3methylpent2enedioicacid
(2E4E)4(24dimethoxybenzylidene)3methylpent2enedioicacid
(E4E)4((24DIMETHOXYPHENYL)METHYLIDENE)3METHYLPENT2ENEDIOICACID
1770846
374699373
COc1cc(OC)ccc1C=C(C(=CC(=O)O)C)C(=O)O
InChI=1SC15H16O6c19(614(16)17)12(15(18)19)7104511(202)813(10)213h48H13H3(H1617)(H1819)b96+127+
MFCD01546137
ZINC000005380755
ZINC5380755

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Available files

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