Vitas-M small molecule compound

1-(3,5-di-tert-butyl-4-hydroxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carbolin-2-ium-3-carboxylate

Catalog ID
STL528529
SMILES [O-]C(=O)C1Cc2c3ccccc3[nH]c2C([NH2+]1)c1cc(c(c(c1)C(C)(C)C)O)C(C)(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 C26H32N2O3 MW 420.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N2O3/c1-25(2,3)17-11-14(12-18(23(17)29)26(4,5)6)21-22-16(13-20(28-21)24(30)31)15-9-7-8-10-19(15)27-22/h7-12,20-21,27-29H,13H2,1-6H3,(H,30,31)
InChIKey
KHIKJXCMDHIUIT-UHFFFAOYSA-N
Synonyms
1030927-22-0
1(35di~(tert)butyl4hydroxyphenyl)2349tetrahydro1~(H)pyrido(34b)indol2ium3carboxylate
1(35ditertbutyl4hydroxyphenyl)2349tetrahydro1Hbetacarbolin2ium3carboxylate
1030927220
3991283
MFCD02185078
ZINC000001816473

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Available files

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