Vitas-M small molecule compound
1-(2-hydroxy-3-methyl-5-nitrophenyl)-2,3,4,9-tetrahydro-1H-beta-carbolin-2-ium-3-carboxylate
Catalog ID
STL528486
SMILES [O-]C(=O)C1Cc2c3ccccc3[nH]c2C([NH2+]1)c1cc(cc(c1O)C)[N+](=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 C19H17N3O5 MW 367.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O5/c1-9-6-10(22(26)27)7-13(18(9)23)17-16-12(8-15(21-17)19(24)25)11-4-2-3-5-14(11)20-16/h2-7,15,17,20-21,23H,8H2,1H3,(H,24,25)InChIKey
CTIPGICZGLESJX-UHFFFAOYSA-NSynonyms
1008014-94-51(2hydroxy3methyl5nitrophenyl)2349tetrahydro1~(H)pyrido(34b)indol2ium3carboxylate
1(2hydroxy3methyl5nitrophenyl)2349tetrahydro1Hbetacarbolin2ium3carboxylate
1008014945
3592967
InChI=1SC19H17N3O5c19610(22(26)27)713(18(9)23)171612(815(2117)19(24)25)11423514(11)2016h271517202123H8H21H3(H2425)
MFCD02185084
ZINC000012659846
ZINC000012659851
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Check stock on Vitas-MAvailable files
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