Vitas-M small molecule compound
2-phenoxyethyl 4-(3-hydroxyphenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363752
SMILES COc1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1cccc(c1)O)C(=O)OCCOc1ccccc1)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 C32H31NO6 MW 525.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31NO6/c1-20-29(32(36)39-16-15-38-26-9-4-3-5-10-26)30(22-7-6-8-24(34)17-22)31-27(33-20)18-23(19-28(31)35)21-11-13-25(37-2)14-12-21/h3-14,17,23,30,33-34H,15-16,18-19H2,1-2H3InChIKey
AYYIKCXBGDTBGI-UHFFFAOYSA-NSynonyms
2phenoxyethyl4(3hydroxyphenyl)7(4methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2phenoxyethyl4(3hydroxyphenyl)7(4methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)OC)C4=CC(=CC=C4)O)C(=O)OCCOC5=CC=CC=C5
InChI=1SC32H31NO6c12029(32(36)391615382694351026)30(2276824(34)1722)3127(3320)1823(1928(31)35)21111325(372)141221h3141723303334H15161819H212H3
MFCD01655996
ZINC000002776332
ZINC000100079650
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