Vitas-M small molecule compound
cycloheptyl 2-methyl-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK402972
SMILES COc1c(OC)cc(cc1OC)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OC1CCCCCC1
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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 C27H35NO6 MW 469.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H35NO6/c1-16-23(27(30)34-18-10-7-5-6-8-11-18)24(25-19(28-16)12-9-13-20(25)29)17-14-21(31-2)26(33-4)22(15-17)32-3/h14-15,18,24,28H,5-13H2,1-4H3InChIKey
WLLFJJGWTWKWDV-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C(=C3)OC)OC)OC)C(=O)OC4CCCCCC4
cycloheptyl2methyl5oxo4(345trimethoxyphenyl)145678hexahydroquinoline3carboxylate
cycloheptyl2methyl5oxo4(345trimethoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
InChI=1SC27H35NO6c11623(27(30)34181075681118)24(2519(2816)1291320(25)29)171421(312)26(334)22(1517)323h1415182428H513H214H3
MFCD03145213
ZINC000001151716
ZINC000001151717
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