Vitas-M small molecule compound
2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(2,4-dihydroxy-3-methylphenyl)ethanone
Catalog ID
STL512420
SMILES O=C(c1ccc(c(c1O)C)O)Cc1ccc2c(c1)OCCCO2
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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 C18H18O5 MW 314.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18O5/c1-11-14(19)5-4-13(18(11)21)15(20)9-12-3-6-16-17(10-12)23-8-2-7-22-16/h3-6,10,19,21H,2,7-9H2,1H3InChIKey
ASQVFGVNEMRQOR-UHFFFAOYSA-NSynonyms
2(2H3H4HBENZO(B)14DIOXEPIN7YL)1(24DIHYDROXY3METHYLPHENYL)ETHAN1ONE
2(34dihydro2~(H)15benzodioxepin7yl)1(24dihydroxy3methylphenyl)ethanone
2(34dihydro2H15benzodioxepin7yl)1(24dihydroxy3methylphenyl)ethanone
2(34DIHYDRO2HBENZO(B)(14)DIOXEPIN7YL)1(24DIHYDROXY3METHYLPHENYL)ETHANONE
202914407
728451
InChI=1SC18H18O5c11114(19)5413(18(11)21)15(20)912361617(1012)238272216h36101921H279H21H3
MFCD00991501
ZINC000000138880
ZINC138880
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