Vitas-M small molecule compound
[1-(3,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](3-fluorophenyl)methanone
Catalog ID
STL345476
SMILES COc1cc(ccc1OC)C1N(CCC2(C1CCCC2)O)C(=O)c1cccc(c1)F
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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 C24H28FNO4 MW 413.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28FNO4/c1-29-20-10-9-16(15-21(20)30-2)22-19-8-3-4-11-24(19,28)12-13-26(22)23(27)17-6-5-7-18(25)14-17/h5-7,9-10,14-15,19,22,28H,3-4,8,11-13H2,1-2H3InChIKey
VUVFQCYTYWGZNW-UHFFFAOYSA-NSynonyms
1009228-41-4(1(34dimethoxyphenyl)4ahydroxy13456788aoctahydroisoquinolin2yl)(3fluorophenyl)methanone
(1(34dimethoxyphenyl)4ahydroxyoctahydroisoquinolin2(1H)yl)(3fluorophenyl)methanone
1(34DIMETHOXYPHENYL)2((3FLUOROPHENYL)CARBONYL)OCTAHYDROISOQUINOLIN4A(2H)OL
1009228414
COC1=C(C=C(C=C1)C2C3CCCCC3(CCN2C(=O)C4=CC(=CC=C4)F)O)OC
InChI=1SC24H28FNO4c1292010916(1521(20)302)22198341124(1928)121326(22)23(27)1765718(25)1417h579101415192228H3481113H212H3
MFCD04188575
ZINC000002423744
ZINC000013778536
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