Vitas-M small molecule compound
9-[3-ethoxy-4-(prop-2-yn-1-yloxy)phenyl]-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STK198896
SMILES C#CCOc1ccc(cc1OCC)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 C28H32O5 MW 448.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32O5/c1-7-11-32-20-10-9-17(12-21(20)31-8-2)24-25-18(29)13-27(3,4)15-22(25)33-23-16-28(5,6)14-19(30)26(23)24/h1,9-10,12,24H,8,11,13-16H2,2-6H3InChIKey
XZZQAAPHFLQVLN-UHFFFAOYSA-NSynonyms
9(3ethoxy4(prop2yn1yloxy)phenyl)3366tetramethyl345679hexahydro1Hxanthene18(2H)dione
9(3ethoxy4prop2ynoxyphenyl)3366tetramethyl4579tetrahydro2Hxanthene18dione
CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)(C)C)OC4=C2C(=O)CC(C4)(C)C)OCC#C
InChI=1SC28H32O5c1711322010917(1221(20)3182)242518(29)1327(34)1522(25)33231628(56)1419(30)26(23)24h19101224H8111316H226H3
MFCD03707533
ZINC000002997580
ZINC02997580
ZINC2997580
Check stock
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