Vitas-M small molecule compound

6-(2,5-dimethylphenyl)-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridine-4-carboxylic acid

Catalog ID
STK686379
SMILES Cc1ccc(c(c1)C1Nc2c(cccc2C2C1C1CCC2C1)C(=O)O)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 C23H25NO2 MW 347.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25NO2/c1-12-6-7-13(2)18(10-12)22-20-15-9-8-14(11-15)19(20)16-4-3-5-17(23(25)26)21(16)24-22/h3-7,10,14-15,19-20,22,24H,8-9,11H2,1-2H3,(H,25,26)
InChIKey
XEODHVPTWTZTLA-UHFFFAOYSA-N
Synonyms

6(25dimethylphenyl)566a7891010aoctahydro710methanophenanthridine4carboxylicacid
CC1=CC(=C(C=C1)C)C2C3C4CCC(C4)C3C5=CC=CC(=C5N2)C(=O)O
InChI=1SC23H25NO2c1126713(2)18(1012)2220159814(1115)19(20)1643517(23(25)26)21(16)2422h3710141519202224H8911H212H3(H2526)
MFCD06015713
ZINC000197188804
ZINC000245257219

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.