Vitas-M small molecule compound
3-cyclohexyl 6-methyl 4-(4-hydroxy-3-methoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK404444
SMILES COC(=O)C1C(C)CC2=C(C1=O)C(c1ccc(c(c1)OC)O)C(=C(N2)C)C(=O)OC1CCCCC1
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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 C27H33NO7 MW 483.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33NO7/c1-14-12-18-24(25(30)21(14)26(31)34-4)23(16-10-11-19(29)20(13-16)33-3)22(15(2)28-18)27(32)35-17-8-6-5-7-9-17/h10-11,13-14,17,21,23,28-29H,5-9,12H2,1-4H3InChIKey
ZMPRRAIYBIUMFA-UHFFFAOYSA-NSynonyms
1005175-28-91005175289
3cyclohexyl6methyl4(4hydroxy3methoxyphenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3Ocyclohexyl6Omethyl4(4hydroxy3methoxyphenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CC1CC2=C(C(C(=C(N2)C)C(=O)OC3CCCCC3)C4=CC(=C(C=C4)O)OC)C(=O)C1C(=O)OC
InChI=1SC27H33NO7c114121824(25(30)21(14)26(31)344)23(16101119(29)20(1316)333)22(15(2)2818)27(32)35178657917h101113141721232829H5912H214H3
MFCD04226218
ZINC000012139769
ZINC000239439143
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