Vitas-M small molecule compound
9-[3-ethoxy-4-(naphthalen-1-ylmethoxy)phenyl]-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STK198878
SMILES CCOc1cc(ccc1OCc1cccc2c1cccc2)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 C32H30O5 MW 494.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30O5/c1-2-35-29-18-21(16-17-26(29)36-19-22-10-5-9-20-8-3-4-11-23(20)22)30-31-24(33)12-6-14-27(31)37-28-15-7-13-25(34)32(28)30/h3-5,8-11,16-18,30H,2,6-7,12-15,19H2,1H3InChIKey
GQRCAIHXAXGVEA-UHFFFAOYSA-NSynonyms
9(3ethoxy4(naphthalen1ylmethoxy)phenyl)345679hexahydro1Hxanthene18(2H)dione
9(3ethoxy4(naphthalen1ylmethoxy)phenyl)345679hexahydro2Hxanthene18dione
CCOC1=C(C=CC(=C1)C2C3=C(CCCC3=O)OC4=C2C(=O)CCC4)OCC5=CC=CC6=CC=CC=C65
InChI=1SC32H30O5c1235291821(161726(29)3619221059208341123(20)22)303124(33)1261427(31)37281571325(34)32(28)30h35811161830H267121519H21H3
MFCD03708012
ZINC000001158054
ZINC01158054
ZINC1158054
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