Vitas-M small molecule compound
2-phenoxyethyl 4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363387
SMILES CCOc1cc(ccc1O)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 C27H29NO6 MW 463.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29NO6/c1-3-32-23-16-18(12-13-21(23)29)25-24(17(2)28-20-10-7-11-22(30)26(20)25)27(31)34-15-14-33-19-8-5-4-6-9-19/h4-6,8-9,12-13,16,25,28-29H,3,7,10-11,14-15H2,1-2H3InChIKey
ZFCYPIURPZMDKP-UHFFFAOYSA-NSynonyms
313244-64-32phenoxyethyl4(3ethoxy4hydroxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2phenoxyethyl4(3ethoxy4hydroxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
313244643
CCOC1=C(C=CC(=C1)C2C3=C(CCCC3=O)NC(=C2C(=O)OCCOC4=CC=CC=C4)C)O
InChI=1SC27H29NO6c1332231618(121321(23)29)2524(17(2)28201071122(30)26(20)25)27(31)34151433198546919h4689121316252829H3710111415H212H3
MFCD01367236
ZINC000004067391
ZINC000004067392
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