Vitas-M small molecule compound
2-phenoxyethyl 4-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363354
SMILES COc1ccc(cc1OC)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/c1-17-24(27(30)34-15-14-33-19-8-5-4-6-9-19)25(26-20(28-17)10-7-11-21(26)29)18-12-13-22(31-2)23(16-18)32-3/h4-6,8-9,12-13,16,25,28H,7,10-11,14-15H2,1-3H3InChIKey
IOKMRQXKIALKLL-UHFFFAOYSA-NSynonyms
2phenoxyethyl4(34dimethoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2phenoxyethyl4(34dimethoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3)OC)OC)C(=O)OCCOC4=CC=CC=C4
InChI=1SC27H29NO6c11724(27(30)34151433198546919)25(2620(2817)1071121(26)29)18121322(312)23(1618)323h46891213162528H710111415H213H3
MFCD01191819
ZINC000019848585
ZINC000019848587
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