Vitas-M small molecule compound
1-[7-(acetyloxy)-4-oxo-4H-chromen-3-yl]-2,3,4,9-tetrahydro-1H-beta-carbolin-2-ium-3-carboxylate
Catalog ID
STL528314
SMILES CC(=O)Oc1ccc2c(c1)occ(c2=O)C1[NH2+]C(Cc2c1[nH]c1c2cccc1)C(=O)[O-]
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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 C23H18N2O6 MW 418.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N2O6/c1-11(26)31-12-6-7-14-19(8-12)30-10-16(22(14)27)21-20-15(9-18(25-21)23(28)29)13-4-2-3-5-17(13)24-20/h2-8,10,18,21,24-25H,9H2,1H3,(H,28,29)InChIKey
QLPUCPGOPUIEDP-UHFFFAOYSA-NSynonyms
1024018-69-61(7(acetyloxy)4oxo4Hchromen3yl)2349tetrahydro1Hbetacarbolin2ium3carboxylate
1(7acetyloxy4oxochromen3yl)2349tetrahydro1~(H)pyrido(34b)indol2ium3carboxylate
1024018696
3978159
InChI=1SC23H18N2O6c111(26)3112671419(812)301016(22(14)27)212015(918(2521)23(28)29)13423517(13)2420h281018212425H9H21H3(H2829)
MFCD02185331
ZINC000001830143
ZINC000001830146
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