Vitas-M small molecule compound

2-[4a-hydroxy-1-(4-hydroxy-3-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-N-pentylacetamide

Catalog ID
STL531480
SMILES CCCCCNC(=O)CN1CCC2(C(C1c1ccc(c(c1)OC)O)CCCC2)O

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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 C23H36N2O4 MW 404.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H36N2O4/c1-3-4-7-13-24-21(27)16-25-14-12-23(28)11-6-5-8-18(23)22(25)17-9-10-19(26)20(15-17)29-2/h9-10,15,18,22,26,28H,3-8,11-14,16H2,1-2H3,(H,24,27)
InChIKey
COYIMEITIZUVMK-UHFFFAOYSA-N
Synonyms

2((1R)4ahydroxy1(4hydroxy3methoxyphenyl)octahydroisoquinolin2(1H)yl)Npentylacetamide
2(4~(a)hydroxy1(4hydroxy3methoxyphenyl)13456788~(a)octahydroisoquinolin2yl)~(N)pentylacetamide
2(4ahydroxy1(4hydroxy3methoxyphenyl)octahydroisoquinolin2(1H)yl)Npentylacetamide
2(6HYDROXY2(4HYDROXY3METHOXYPHENYL)3AZABICYCLO(440)DEC3YL)NPENTYLACETAMIDE
4318569
CCCCCNC(=O)CN1CCC2(C((C@@H)1c1ccc(c(c1)OC)O)CCCC2)O
InChI=1SC23H36N2O4c1347132421(27)1625141223(28)1165818(23)22(25)1791019(26)20(1517)292h9101518222628H38111416H212H3(H2427)
MFCD04144283
ZINC000002156081
ZINC000248237315

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Available files

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