Vitas-M small molecule compound
2-methoxyethyl 4-(1,3-benzodioxol-5-yl)-7-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK403456
SMILES COCCOC(=O)C1=C(C)NC2=C(C1c1ccc3c(c1)OCO3)C(=O)CC(C2)c1ccc(c(c1)OC)OCC
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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 C30H33NO8 MW 535.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33NO8/c1-5-36-23-8-6-18(14-25(23)35-4)20-12-21-29(22(32)13-20)28(19-7-9-24-26(15-19)39-16-38-24)27(17(2)31-21)30(33)37-11-10-34-3/h6-9,14-15,20,28,31H,5,10-13,16H2,1-4H3InChIKey
KAQQNHCRMPBFSE-UHFFFAOYSA-NSynonyms
2methoxyethyl4(13benzodioxol5yl)7(4ethoxy3methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2methoxyethyl4(13benzodioxol5yl)7(4ethoxy3methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CCOC1=C(C=C(C=C1)C2CC3=C(C(C(=C(N3)C)C(=O)OCCOC)C4=CC5=C(C=C4)OCO5)C(=O)C2)OC
InChI=1SC30H33NO8c1536238618(1425(23)354)20122129(22(32)1320)28(19792426(1519)39163824)27(17(2)3121)30(33)371110343h691415202831H5101316H214H3
MFCD03489297
ZINC000097939668
ZINC000097939671
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