Vitas-M small molecule compound
[(1R,4aS,8aS)-4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl](phenyl)methanone
Catalog ID
STL548675
SMILES COc1ccccc1[C@@H]1N(CC[C@@]2([C@H]1CCCC2)O)C(=O)c1ccccc1
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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 C23H27NO3 MW 365.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27NO3/c1-27-20-13-6-5-11-18(20)21-19-12-7-8-14-23(19,26)15-16-24(21)22(25)17-9-3-2-4-10-17/h2-6,9-11,13,19,21,26H,7-8,12,14-16H2,1H3/t19-,21-,23-/m0/s1InChIKey
FPPSKLSVFGKMQD-RRPUWOKSSA-NSynonyms
956811-43-1((1~(R)4~(a)~(S)8~(a)~(S))4~(a)hydroxy1(2methoxyphenyl)13456788~(a)octahydroisoquinolin2yl)phenylmethanone
((1R)4ahydroxy1(2methoxyphenyl)octahydroisoquinolin2(1H)yl)(phenyl)methanone
((1R4aS8aS)4ahydroxy1(2methoxyphenyl)octahydroisoquinolin2(1H)yl)(phenyl)methanone
7087035
956811431
COc1ccccc1(C@@H)1N(CCC2(C1CCCC2)O)C(=O)c1ccccc1
InChI=1SC23H27NO3c1272013651118(20)211912781423(1926)151624(21)22(25)1793241017h2691113192126H78121416H21H3t192123m0s1
MFCD06764418
ZINC000004062222
ZINC4062222
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