Vitas-M small molecule compound
(3aS,4R,9bR)-8-bromo-4-(3-bromophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxylic acid
Catalog ID
STK523308
SMILES Brc1cccc(c1)[C@@H]1Nc2c([C@H]3[C@@H]1CC=C3)cc(cc2C(=O)O)Br
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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 C19H15Br2NO2 MW 449.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15Br2NO2/c20-11-4-1-3-10(7-11)17-14-6-2-5-13(14)15-8-12(21)9-16(19(23)24)18(15)22-17/h1-5,7-9,13-14,17,22H,6H2,(H,23,24)/t13-,14+,17+/m1/s1InChIKey
JLCPQEBHYWSXSS-KEYYUXOJSA-NSynonyms
(3aS4R9bR)8bromo4(3bromophenyl)3a459btetrahydro3Hcyclopenta(c)quinoline6carboxylicacid
Brc1cccc(c1)(C@@H)1Nc2c((C@H)3(C@@H)1CC=C3)cc(cc2C(=O)O)Br
C1C=CC2C1C(NC3=C2C=C(C=C3C(=O)O)Br)C4=CC(=CC=C4)Br
InChI=1SC19H15Br2NO2c201141310(711)171462513(14)15812(21)916(19(23)24)18(15)2217h157913141722H6H2(H2324)t1314+17+m1s1
MFCD18241529
ZINC000012428636
ZINC12428636
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