Vitas-M small molecule compound
(2S,3R)-2-(5-ethyl-8-oxo-5,8-dihydro-[1,3]dioxolo[4,5-g]quinoline-7-carboxamido)-3-methylpentanoic acid
Catalog ID
STL537802
SMILES CCC([C@@H](C(=O)O)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1)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 C19H22N2O6 MW 374.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N2O6/c1-4-10(3)16(19(24)25)20-18(23)12-8-21(5-2)13-7-15-14(26-9-27-15)6-11(13)17(12)22/h6-8,10,16H,4-5,9H2,1-3H3,(H,20,23)(H,24,25)/t10?,16-/m0/s1InChIKey
XYQCSTPSQQNGIA-CSPPYYTDSA-NSynonyms
(2~(S))2((5ethyl8oxo(13)dioxolo(45g)quinoline7carbonyl)amino)3methylpentanoicacid
(2S3R)2(5ETHYL8OXO58DIHYDRO(13)DIOXOLO(45G)QUINOLINE7CARBOXAMIDO)3METHYLPENTANOICACID
16394772
CCC((C@@H)(C(=O)O)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1)C
InChI=1SC19H22N2O6c1410(3)16(19(24)25)2018(23)12821(52)1371514(2692715)611(13)17(12)22h681016H459H213H3(H2023)(H2425)t10?16m0s1
ZINC000006645559
ZINC000012895811
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