Vitas-M small molecule compound
(2E)-1-(1,3-benzodioxol-5-yl)-3-(2,3,4-trimethoxyphenyl)prop-2-en-1-one
Catalog ID
STK693277
SMILES COc1c(/C=C/C(=O)c2ccc3c(c2)OCO3)ccc(c1OC)OC
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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 C19H18O6 MW 342.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18O6/c1-21-16-9-5-12(18(22-2)19(16)23-3)4-7-14(20)13-6-8-15-17(10-13)25-11-24-15/h4-10H,11H2,1-3H3/b7-4+InChIKey
FSIMGKYEOKOUSI-QPJJXVBHSA-NSynonyms
(2E)1(13benzodioxol5yl)3(234trimethoxyphenyl)prop2en1one
(2E)1(2HBENZO(D)13DIOXOLAN5YL)3(234TRIMETHOXYPHENYL)PROP2EN1ONE
(E)1(13BENZODIOXOL5YL)3(234TRIMETHOXYPHENYL)PROP2EN1ONE
COC1=C(C(=C(C=C1)C=CC(=O)C2=CC3=C(C=C2)OCO3)OC)OC
COc1c(C=CC(=O)c2ccc3c(c2)OCO3)ccc(c1OC)OC
InChI=1SC19H18O6c121169512(18(222)19(16)233)4714(20)13681517(1013)25112415h410H11H213H3b74+
MFCD10039378
ZINC000007743640
ZINC07743640
ZINC7743640
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