Vitas-M small molecule compound
2-phenoxyethyl 4-[3-methoxy-2-(propan-2-yloxy)phenyl]-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK407162
SMILES COc1cccc(c1OC(C)C)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCCOc1ccccc1
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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 C29H33NO6 MW 491.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33NO6/c1-18(2)36-28-21(12-8-15-24(28)33-4)26-25(19(3)30-22-13-9-14-23(31)27(22)26)29(32)35-17-16-34-20-10-6-5-7-11-20/h5-8,10-12,15,18,26,30H,9,13-14,16-17H2,1-4H3InChIKey
OKWJMZOODBKPOM-UHFFFAOYSA-NSynonyms
2phenoxyethyl4(3methoxy2(propan2yloxy)phenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2phenoxyethyl4(3methoxy2propan2yloxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CCCC2=O)C3=C(C(=CC=C3)OC)OC(C)C)C(=O)OCCOC4=CC=CC=C4
InChI=1SC29H33NO6c118(2)362821(1281524(28)334)2625(19(3)30221391423(31)27(22)26)29(32)3517163420106571120h58101215182630H913141617H214H3
MFCD07402526
ZINC000020568855
ZINC000020568856
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