Vitas-M small molecule compound
9-(3,4-dihydroxyphenyl)-3,6-diphenyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STK527078
SMILES O=C1CC(CC2=C1C(c1ccc(c(c1)O)O)C1=C(O2)CC(CC1=O)c1ccccc1)c1ccccc1
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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 C31H26O5 MW 478.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26O5/c32-23-12-11-20(13-24(23)33)29-30-25(34)14-21(18-7-3-1-4-8-18)16-27(30)36-28-17-22(15-26(35)31(28)29)19-9-5-2-6-10-19/h1-13,21-22,29,32-33H,14-17H2InChIKey
AAELFPNIHJJWMU-UHFFFAOYSA-NSynonyms
459783-87-0459783870
9(34dihydroxyphenyl)36diphenyl345679hexahydro1Hxanthene18(2H)dione
9(34dihydroxyphenyl)36diphenyl345679hexahydro2Hxanthene18dione
C1C(CC(=O)C2=C1OC3=C(C2C4=CC(=C(C=C4)O)O)C(=O)CC(C3)C5=CC=CC=C5)C6=CC=CC=C6
InChI=1SC31H26O5c3223121120(1324(23)33)293025(34)1421(187314818)1627(30)36281722(1526(35)31(28)29)1995261019h1132122293233H1417H2
MFCD00698885
ZINC000000974929
ZINC000238997198
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