Vitas-M small molecule compound
2-(2-chlorobenzyl)-1-(4-hydroxy-3-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol
Catalog ID
STK723208
SMILES COc1cc(ccc1O)C1N(CCC2(C1CCCC2)O)Cc1ccccc1Cl
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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 C23H28ClNO3 MW 401.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28ClNO3/c1-28-21-14-16(9-10-20(21)26)22-18-7-4-5-11-23(18,27)12-13-25(22)15-17-6-2-3-8-19(17)24/h2-3,6,8-10,14,18,22,26-27H,4-5,7,11-13,15H2,1H3InChIKey
YQITXDDUZAGSSZ-UHFFFAOYSA-NSynonyms
(1R4aS8aS)2(2chlorobenzyl)1(4hydroxy3methoxyphenyl)decahydroisoquinolin4aol
(1S4AR8AS)2(2CHLOROBENZYL)1(4HYDROXY3METHOXYPHENYL)OCTAHYDROISOQUINOLIN4A(2H)OL
2((2chlorophenyl)methyl)1(4hydroxy3methoxyphenyl)13456788aoctahydroisoquinolin4aol
2(2chlorobenzyl)1(4hydroxy3methoxyphenyl)octahydroisoquinolin4a(2H)ol
4((2CHLOROPHENYL)METHYL)5(4HYDROXY3METHOXYPHENYL)4AZABICYCLO(440)DECAN1OL
COC1=C(C=CC(=C1)C2C3CCCCC3(CCN2CC4=CC=CC=C4Cl)O)O
COc1cc(ccc1O)(C@@H)1N(CC(C@@)2((C@H)1CCCC2)O)Cc1ccccc1Cl
InChI=1SC23H28ClNO3c128211416(91020(21)26)22187451123(1827)121325(22)1517623819(17)24h2368101418222627H457111315H21H3
MFCD04195214
ZINC000002203819
ZINC000016009947
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