Vitas-M small molecule compound
1-[3-(1H-benzotriazol-1-ylmethyl)-4-methoxyphenyl]-2,3,4,9-tetrahydro-1H-beta-carbolin-2-ium-3-carboxylate
Catalog ID
STL528390
SMILES COc1ccc(cc1Cn1nnc2c1cccc2)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 C26H23N5O3 MW 453.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N5O3/c1-34-23-11-10-15(12-16(23)14-31-22-9-5-4-8-20(22)29-30-31)24-25-18(13-21(28-24)26(32)33)17-6-2-3-7-19(17)27-25/h2-12,21,24,27-28H,13-14H2,1H3,(H,32,33)InChIKey
RLNKKIKRXDRZKK-UHFFFAOYSA-NSynonyms
1022924-71-51(3(1Hbenzotriazol1ylmethyl)4methoxyphenyl)2349tetrahydro1Hbetacarbolin2ium3carboxylate
1(3(benzotriazol1ylmethyl)4methoxyphenyl)2349tetrahydro1~(H)pyrido(34b)indol2ium3carboxylate
1022924715
3255925
MFCD03267582
ZINC000008837255
ZINC000008837258
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