Vitas-M small molecule compound

9-[2-(4-hydroxyphenyl)-2-oxoethyl]-3,3-dimethyl-2,3,4,9-tetrahydro-1H-xanthen-1-one

Catalog ID
STK086622
SMILES Oc1ccc(cc1)C(=O)CC1C2=C(Oc3c1cccc3)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 C23H22O4 MW 362.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22O4/c1-23(2)12-19(26)22-17(11-18(25)14-7-9-15(24)10-8-14)16-5-3-4-6-20(16)27-21(22)13-23/h3-10,17,24H,11-13H2,1-2H3
InChIKey
MGJUOHMAFACQFM-UHFFFAOYSA-N
Synonyms
5119-57-3
5119573
9(2(4hydroxyphenyl)2oxoethyl)33dimethyl2349tetrahydro1Hxanthen1one
9(2(4HYDROXYPHENYL)2OXOETHYL)33DIMETHYL49DIHYDRO2HXANTHEN1ONE
CC1(CC2=C(C(C3=CC=CC=C3O2)CC(=O)C4=CC=C(C=C4)O)C(=O)C1)C
InChI=1SC23H22O4c123(2)1219(26)2217(1118(25)147915(24)10814)16534620(16)2721(22)1323h3101724H1113H212H3
MFCD01460915
Oc1ccc(cc1)C(=O)CC1C2=C(Oc3c1cccc3)CC(CC2=O)(C)C
STK086622
ZINC000001024371
ZINC000001024373

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Available files

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