Vitas-M small molecule compound
pentyl 4-(4-ethylphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372540
SMILES CCCCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)CC)C(=O)CC(C2)(C)C
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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 C26H35NO3 MW 409.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H35NO3/c1-6-8-9-14-30-25(29)22-17(3)27-20-15-26(4,5)16-21(28)24(20)23(22)19-12-10-18(7-2)11-13-19/h10-13,23,27H,6-9,14-16H2,1-5H3InChIKey
PQJYIXZOKKKYIZ-UHFFFAOYSA-NSynonyms
CCCCCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)CC)C(=O)CC(C2)(C)C)C
InChI=1SC26H35NO3c1689143025(29)2217(3)27201526(45)1621(28)24(20)23(22)19121018(72)111319h10132327H691416H215H3
MFCD00753054
pentyl4(4ethylphenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
pentyl4(4ethylphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
ZINC000002055183
ZINC000002055184
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Check stock on Vitas-MAvailable files
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