Vitas-M small molecule compound
9-(3-bromo-4-hydroxy-5-methoxyphenyl)-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STK198867
SMILES COc1cc(cc(c1O)Br)C1C2=C(CCCC2=O)OC2=C1C(=O)CCC2
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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 C20H19BrO5 MW 419.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19BrO5/c1-25-16-9-10(8-11(21)20(16)24)17-18-12(22)4-2-6-14(18)26-15-7-3-5-13(23)19(15)17/h8-9,17,24H,2-7H2,1H3InChIKey
STOPSZCSKDJMSP-UHFFFAOYSA-NSynonyms
354781-74-1354781741
9(3bromo4hydroxy5methoxyphenyl)345679hexahydro1Hxanthene18(2H)dione
9(3bromo4hydroxy5methoxyphenyl)345679hexahydro2Hxanthene18dione
COC1=C(C(=CC(=C1)C2C3=C(CCCC3=O)OC4=C2C(=O)CCC4)Br)O
InChI=1SC20H19BrO5c12516910(811(21)20(16)24)171812(22)42614(18)261573513(23)19(15)17h891724H27H21H3
MFCD02182561
ZINC000001006803
ZINC01006803
ZINC1006803
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