Vitas-M small molecule compound
9-(3-iodo-5-methoxy-4-propoxyphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STK198856
SMILES CCCOc1c(I)cc(cc1OC)C1C2=C(OC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(C)C
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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 C27H33IO5 MW 564.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33IO5/c1-7-8-32-25-16(28)9-15(10-19(25)31-6)22-23-17(29)11-26(2,3)13-20(23)33-21-14-27(4,5)12-18(30)24(21)22/h9-10,22H,7-8,11-14H2,1-6H3InChIKey
XERADPBQBXRBEI-UHFFFAOYSA-NSynonyms
9(3iodo5methoxy4propoxyphenyl)3366tetramethyl345679hexahydro1Hxanthene18(2H)dione
9(3iodo5methoxy4propoxyphenyl)3366tetramethyl4579tetrahydro2Hxanthene18dione
CCCOC1=C(C=C(C=C1I)C2C3=C(CC(CC3=O)(C)C)OC4=C2C(=O)CC(C4)(C)C)OC
InChI=1SC27H33IO5c178322516(28)915(1019(25)316)222317(29)1126(23)1320(23)33211427(45)1218(30)24(21)22h91022H781114H216H3
MFCD02218251
ZINC000002958873
ZINC2958873
Check stock
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Check stock on Vitas-MAvailable files
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