Vitas-M small molecule compound
2-phenylethyl 2,7,7-trimethyl-5-oxo-4-(pyridin-4-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK378280
SMILES O=C(C1=C(C)NC2=C(C1c1ccncc1)C(=O)CC(C2)(C)C)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 C26H28N2O3 MW 416.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O3/c1-17-22(25(30)31-14-11-18-7-5-4-6-8-18)23(19-9-12-27-13-10-19)24-20(28-17)15-26(2,3)16-21(24)29/h4-10,12-13,23,28H,11,14-16H2,1-3H3InChIKey
RFXYBDUOLFJPRS-UHFFFAOYSA-NSynonyms
312586-60-02phenylethyl277trimethyl5oxo4(pyridin4yl)145678hexahydroquinoline3carboxylate
2phenylethyl277trimethyl5oxo4pyridin4yl1468tetrahydroquinoline3carboxylate
312586600
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=NC=C3)C(=O)OCCC4=CC=CC=C4
InChI=1SC26H28N2O3c11722(25(30)311411187546818)23(1991227131019)2420(2817)1526(23)1621(24)29h41012132328H111416H213H3
MFCD01823670
ZINC000019775027
ZINC000019775029
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