Vitas-M small molecule compound
pentyl 2,7,7-trimethyl-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372530
SMILES CCCCCOC(=O)C1=C(C)NC2=C(C1c1cc(OC)c(c(c1)OC)OC)C(=O)CC(C2)(C)C
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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 C27H37NO6 MW 471.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H37NO6/c1-8-9-10-11-34-26(30)22-16(2)28-18-14-27(3,4)15-19(29)24(18)23(22)17-12-20(31-5)25(33-7)21(13-17)32-6/h12-13,23,28H,8-11,14-15H2,1-7H3InChIKey
KTFUTNRIEKKMLR-UHFFFAOYSA-NSynonyms
CCCCCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C(=C3)OC)OC)OC)C(=O)CC(C2)(C)C)C
InChI=1SC27H37NO6c18910113426(30)2216(2)28181427(34)1519(29)24(18)23(22)171220(315)25(337)21(1317)326h12132328H8111415H217H3
MFCD00753019
pentyl277trimethyl5oxo4(345trimethoxyphenyl)145678hexahydroquinoline3carboxylate
pentyl277trimethyl5oxo4(345trimethoxyphenyl)1468tetrahydroquinoline3carboxylate
ZINC000003094383
ZINC000003094384
Check stock
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Check stock on Vitas-MAvailable files
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