Vitas-M small molecule compound
2-propoxyethyl 4-[2-(benzyloxy)phenyl]-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK090378
SMILES CCCOCCOC(=O)C1=C(C)NC2=C(C1c1ccccc1OCc1ccccc1)C(=O)CCC2
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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 C29H33NO5 MW 475.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33NO5/c1-3-16-33-17-18-34-29(32)26-20(2)30-23-13-9-14-24(31)28(23)27(26)22-12-7-8-15-25(22)35-19-21-10-5-4-6-11-21/h4-8,10-12,15,27,30H,3,9,13-14,16-19H2,1-2H3InChIKey
XTCURHDHQWSCHM-UHFFFAOYSA-NSynonyms
2propoxyethyl2methyl5oxo4(2phenylmethoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
2propoxyethyl4(2(benzyloxy)phenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
CCCOCCOC(=O)C1=C(C)NC2=C(C1c1ccccc1OCc1ccccc1)C(=O)CCC2
CCCOCCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3OCC4=CC=CC=C4)C(=O)CCC2)C
InChI=1SC29H33NO5c13163317183429(32)2620(2)30231391424(31)28(23)27(26)2212781525(22)351921105461121h481012152730H3913141619H212H3
MFCD02188772
STK090378
ZINC000002190640
ZINC000002190641
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