Vitas-M small molecule compound

tetrahydrofuran-2-ylmethyl 2-methyl-5-oxo-4-(2,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK056128
SMILES COc1cc(OC)c(cc1C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCC1CCCO1)OC

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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 C25H31NO7 MW 457.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31NO7/c1-14-22(25(28)33-13-15-7-6-10-32-15)23(24-17(26-14)8-5-9-18(24)27)16-11-20(30-3)21(31-4)12-19(16)29-2/h11-12,15,23,26H,5-10,13H2,1-4H3
InChIKey
XOHGTLGSUMEDSM-UHFFFAOYSA-N
Synonyms

CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3OC)OC)OC)C(=O)OCC4CCCO4
COc1cc(OC)c(cc1C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCC1CCCO1)OC
InChI=1SC25H31NO7c11422(25(28)33131576103215)23(2417(2614)85918(24)27)161120(303)21(314)1219(16)292h1112152326H51013H214H3
MFCD02188082
oxolan2ylmethyl2methyl5oxo4(245trimethoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
STK056128
tetrahydrofuran2ylmethyl2methyl5oxo4(245trimethoxyphenyl)145678hexahydroquinoline3carboxylate
ZINC000000716999
ZINC000000717002

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Available files

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