Vitas-M small molecule compound
4-(4-carboxyphenyl)-6-methoxy-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylic acid
Catalog ID
STK686409
SMILES COc1cc(cc2c1NC(c1ccc(cc1)C(=O)O)C1C2C=CC1)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 C21H19NO5 MW 365.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO5/c1-27-17-10-13(21(25)26)9-16-14-3-2-4-15(14)18(22-19(16)17)11-5-7-12(8-6-11)20(23)24/h2-3,5-10,14-15,18,22H,4H2,1H3,(H,23,24)(H,25,26)InChIKey
WNUXNGHJNIWBOG-UHFFFAOYSA-NSynonyms
4(4carboxyphenyl)6methoxy3a459btetrahydro3Hcyclopenta(c)quinoline8carboxylicacid
COC1=CC(=CC2=C1NC(C3C2C=CC3)C4=CC=C(C=C4)C(=O)O)C(=O)O
InChI=1SC21H19NO5c127171013(21(25)26)9161432415(14)18(2219(16)17)115712(8611)20(23)24h2351014151822H4H21H3(H2324)(H2526)
MFCD06015744
ZINC000004623655
ZINC000014944375
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