Vitas-M small molecule compound
3-cyclopentyl 6-methyl 4-(3-hydroxy-4-methoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK404692
SMILES COC(=O)C1C(C)CC2=C(C1=O)C(c1ccc(c(c1)O)OC)C(=C(N2)C)C(=O)OC1CCCC1
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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 C26H31NO7 MW 469.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31NO7/c1-13-11-17-23(24(29)20(13)25(30)33-4)22(15-9-10-19(32-3)18(28)12-15)21(14(2)27-17)26(31)34-16-7-5-6-8-16/h9-10,12-13,16,20,22,27-28H,5-8,11H2,1-4H3InChIKey
MZAWYRBJJLNWCF-UHFFFAOYSA-NSynonyms
3cyclopentyl6methyl4(3hydroxy4methoxyphenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3Ocyclopentyl6Omethyl4(3hydroxy4methoxyphenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CC1CC2=C(C(C(=C(N2)C)C(=O)OC3CCCC3)C4=CC(=C(C=C4)OC)O)C(=O)C1C(=O)OC
InChI=1SC26H31NO7c113111723(24(29)20(13)25(30)334)22(1591019(323)18(28)1215)21(14(2)2717)26(31)3416756816h91012131620222728H5811H214H3
MFCD05031593
ZINC000001460869
ZINC000239164817
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