Vitas-M small molecule compound
2-phenoxyethyl 4-(1,3-benzodioxol-5-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363390
SMILES O=C(C1=C(C)NC2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2)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 C26H25NO6 MW 447.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25NO6/c1-16-23(26(29)31-13-12-30-18-6-3-2-4-7-18)24(25-19(27-16)8-5-9-20(25)28)17-10-11-21-22(14-17)33-15-32-21/h2-4,6-7,10-11,14,24,27H,5,8-9,12-13,15H2,1H3InChIKey
SUBHLCCFBLMMBJ-UHFFFAOYSA-NSynonyms
313244-70-12phenoxyethyl4(13benzodioxol5yl)2methyl5oxo145678hexahydroquinoline3carboxylate
2phenoxyethyl4(13benzodioxol5yl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
313244701
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC4=C(C=C3)OCO4)C(=O)OCCOC5=CC=CC=C5
InChI=1SC26H25NO6c11623(26(29)31131230186324718)24(2519(2716)85920(25)28)1710112122(1417)33153221h24671011142427H589121315H21H3
MFCD01367243
ZINC000002083515
ZINC000002083516
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