Vitas-M small molecule compound
cyclopentyl 7-(2-methoxyphenyl)-2-methyl-5-oxo-4-(2,3,4-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK403058
SMILES COc1c(OC)ccc(c1OC)C1C2=C(NC(=C1C(=O)OC1CCCC1)C)CC(CC2=O)c1ccccc1OC
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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 C32H37NO7 MW 547.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H37NO7/c1-18-27(32(35)40-20-10-6-7-11-20)28(22-14-15-26(37-3)31(39-5)30(22)38-4)29-23(33-18)16-19(17-24(29)34)21-12-8-9-13-25(21)36-2/h8-9,12-15,19-20,28,33H,6-7,10-11,16-17H2,1-5H3InChIKey
XPNNBINOIFWQSZ-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3OC)C4=C(C(=C(C=C4)OC)OC)OC)C(=O)OC5CCCC5
cyclopentyl7(2methoxyphenyl)2methyl5oxo4(234trimethoxyphenyl)145678hexahydroquinoline3carboxylate
cyclopentyl7(2methoxyphenyl)2methyl5oxo4(234trimethoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
InChI=1SC32H37NO7c11827(32(35)402010671120)28(22141526(373)31(395)30(22)384)2923(3318)1619(1724(29)34)2112891325(21)362h89121519202833H6710111617H215H3
MFCD03371063
ZINC000001438828
ZINC000001438831
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