Vitas-M small molecule compound
propyl 4-(3-methoxy-4-propoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372290
SMILES CCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)OCCC)C(=O)CC(C2)(C)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 C26H35NO5 MW 441.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H35NO5/c1-7-11-31-20-10-9-17(13-21(20)30-6)23-22(25(29)32-12-8-2)16(3)27-18-14-26(4,5)15-19(28)24(18)23/h9-10,13,23,27H,7-8,11-12,14-15H2,1-6H3InChIKey
SZUBJTPRYPQCBJ-UHFFFAOYSA-NSynonyms
CCCOC1=C(C=C(C=C1)C2C3=C(CC(CC3=O)(C)C)NC(=C2C(=O)OCCC)C)OC
InChI=1SC26H35NO5c1711312010917(1321(20)306)2322(25(29)321282)16(3)27181426(45)1519(28)24(18)23h910132327H7811121415H216H3
MFCD00753274
propyl4(3methoxy4propoxyphenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
propyl4(3methoxy4propoxyphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
ZINC000004060721
ZINC000004060722
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.