Vitas-M small molecule compound
methyl 4-[4-methoxy-3-(methoxymethyl)phenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK961015
SMILES COCc1cc(ccc1OC)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC
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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 C23H29NO5 MW 399.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29NO5/c1-13-19(22(26)29-6)20(14-7-8-18(28-5)15(9-14)12-27-4)21-16(24-13)10-23(2,3)11-17(21)25/h7-9,20,24H,10-12H2,1-6H3InChIKey
ZBZNJNLBHBNIKM-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=C(C=C3)OC)COC)C(=O)OC
InChI=1SC23H29NO5c11319(22(26)296)20(147818(285)15(914)12274)2116(2413)1023(23)1117(21)25h792024H1012H216H3
methyl4(4methoxy3(methoxymethyl)phenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
methyl4(4methoxy3(methoxymethyl)phenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
MFCD02243722
ZINC000002769606
ZINC000002769607
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