Vitas-M small molecule compound
2-phenylethyl 4-(3-ethoxy-4-hydroxyphenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363724
SMILES CCOc1cc(ccc1O)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccc(cc1)OC)C(=O)OCCc1ccccc1
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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 C34H35NO6 MW 553.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H35NO6/c1-4-40-30-20-24(12-15-28(30)36)32-31(34(38)41-17-16-22-8-6-5-7-9-22)21(2)35-27-18-25(19-29(37)33(27)32)23-10-13-26(39-3)14-11-23/h5-15,20,25,32,35-36H,4,16-19H2,1-3H3InChIKey
RDNRFMJRXXIZHQ-UHFFFAOYSA-NSynonyms
2phenylethyl4(3ethoxy4hydroxyphenyl)7(4methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2phenylethyl4(3ethoxy4hydroxyphenyl)7(4methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)OC)NC(=C2C(=O)OCCC5=CC=CC=C5)C)O
InChI=1SC34H35NO6c1440302024(121528(30)36)3231(34(38)411716228657922)21(2)35271825(1929(37)33(27)32)23101326(393)141123h5152025323536H41619H213H3
MFCD01571732
ZINC000100076639
ZINC000100076653
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