Vitas-M small molecule compound
2-[(1R,4aS,8aS)-4a-hydroxy-1-(4-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]-1-(piperidin-1-yl)ethanone
Catalog ID
STL549150
SMILES COc1ccc(cc1)[C@@H]1N(CC[C@@]2([C@H]1CCCC2)O)CC(=O)N1CCCCC1
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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 C23H34N2O3 MW 386.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H34N2O3/c1-28-19-10-8-18(9-11-19)22-20-7-3-4-12-23(20,27)13-16-25(22)17-21(26)24-14-5-2-6-15-24/h8-11,20,22,27H,2-7,12-17H2,1H3/t20-,22-,23-/m0/s1InChIKey
LHMSIOPVCHUMCJ-PMVMPFDFSA-NSynonyms
956340-36-62((1~(R)4~(a)~(S)8~(a)~(S))4~(a)hydroxy1(4methoxyphenyl)13456788~(a)octahydroisoquinolin2yl)1piperidin1ylethanone
2((1R)4ahydroxy1(4methoxyphenyl)octahydroisoquinolin2(1H)yl)1(piperidin1yl)ethanone
2((1R4aS8aS)4ahydroxy1(4methoxyphenyl)octahydroisoquinolin2(1H)yl)1(piperidin1yl)ethanone
7087992
956340366
COc1ccc(cc1)(C@@H)1N(CCC2(C1CCCC2)O)CC(=O)N1CCCCC1
InChI=1SC23H34N2O3c1281910818(91119)22207341223(2027)131625(22)1721(26)24145261524h811202227H271217H21H3t202223m0s1
MFCD06764505
ZINC000004064011
ZINC4064011
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