Vitas-M small molecule compound
4-(1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)-2-methoxyphenyl hexanoate
Catalog ID
STK772573
SMILES CCCCCC(=O)Oc1ccc(cc1OC)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 C26H30O6 MW 438.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30O6/c1-3-4-5-12-23(29)32-19-14-13-16(15-22(19)30-2)24-25-17(27)8-6-10-20(25)31-21-11-7-9-18(28)26(21)24/h13-15,24H,3-12H2,1-2H3InChIKey
PCDCDSFRCUGVSZ-UHFFFAOYSA-NSynonyms
(4(18dioxo345679hexahydro2Hxanthen9yl)2methoxyphenyl)hexanoate
4(18dioxo23456789octahydro1Hxanthen9yl)2methoxyphenylhexanoate
CCCCCC(=O)OC1=C(C=C(C=C1)C2C3=C(CCCC3=O)OC4=C2C(=O)CCC4)OC
InChI=1SC26H30O6c13451223(29)3219141316(1522(19)302)242517(27)861020(25)3121117918(28)26(21)24h131524H312H212H3
MFCD03819901
ZINC000003625441
ZINC03625441
ZINC3625441
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