Vitas-M small molecule compound
(2E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(2-hydroxy-5-methoxyphenyl)prop-2-en-1-one
Catalog ID
STK856967
SMILES COc1ccc(c(c1)C(=O)/C=C/c1ccc2c(c1)OCCO2)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 C18H16O5 MW 312.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16O5/c1-21-13-4-6-16(20)14(11-13)15(19)5-2-12-3-7-17-18(10-12)23-9-8-22-17/h2-7,10-11,20H,8-9H2,1H3/b5-2+InChIKey
UMZBYPJNUUPJQM-GORDUTHDSA-NSynonyms
106584-16-1(2E)3(23dihydro14benzodioxin6yl)1(2hydroxy5methoxyphenyl)prop2en1one
(E)3(23DIHYDRO14BENZODIOXIN6YL)1(2HYDROXY5METHOXYPHENYL)PROP2EN1ONE
(E)3(23dihydrobenzo(b)(14)dioxin6yl)1(2hydroxy5methoxyphenyl)prop2en1one
106584161
COC1=CC(=C(C=C1)O)C(=O)C=CC2=CC3=C(C=C2)OCCO3
COc1ccc(c(c1)C(=O)C=Cc1ccc2c(c1)OCCO2)O
InChI=1SC18H16O5c121134616(20)14(1113)15(19)5212371718(1012)23982217h27101120H89H21H3b52+
MFCD00276147
ZINC000004070539
ZINC04070539
ZINC4070539
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