Vitas-M small molecule compound
ethyl (1R,4aS,8aS)-4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinoline-2(1H)-carboxylate
Catalog ID
STL546915
SMILES CCOC(=O)N1CC[C@@]2([C@H]([C@@H]1c1ccccc1OC)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 C19H27NO4 MW 333.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H27NO4/c1-3-24-18(21)20-13-12-19(22)11-7-6-9-15(19)17(20)14-8-4-5-10-16(14)23-2/h4-5,8,10,15,17,22H,3,6-7,9,11-13H2,1-2H3/t15-,17-,19-/m0/s1InChIKey
NCIHKYGLIOZTBC-IEZWGBDMSA-NSynonyms
955961-81-6(1R)ethyl4ahydroxy1(2methoxyphenyl)octahydroisoquinoline2(1H)carboxylate
908581
955961816
CCOC(=O)N1CCC2(C((C@@H)1c1ccccc1OC)CCCC2)O
ethyl(1~(R)4~(a)~(S)8~(a)~(S))4~(a)hydroxy1(2methoxyphenyl)13456788~(a)octahydroisoquinoline2carboxylate
ethyl(1R4aS8aS)4ahydroxy1(2methoxyphenyl)octahydroisoquinoline2(1H)carboxylate
InChI=1SC19H27NO4c132418(21)20131219(22)1176915(19)17(20)148451016(14)232h45810151722H36791113H212H3t151719m0s1
MFCD06764479
ZINC000000490755
ZINC490755
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