Vitas-M small molecule compound
2-(4-chlorobenzyl)-1-(4-hydroxy-3-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol
Catalog ID
STK723209
SMILES COc1cc(ccc1O)C1N(CCC2(C1CCCC2)O)Cc1ccc(cc1)Cl
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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/c1-28-21-14-17(7-10-20(21)26)22-19-4-2-3-11-23(19,27)12-13-25(22)15-16-5-8-18(24)9-6-16/h5-10,14,19,22,26-27H,2-4,11-13,15H2,1H3InChIKey
HAZRINAWSLTYFD-UHFFFAOYSA-NSynonyms
(1R4aS8aS)2(4chlorobenzyl)1(4hydroxy3methoxyphenyl)decahydroisoquinolin4aol
2((4chlorophenyl)methyl)1(4hydroxy3methoxyphenyl)13456788aoctahydroisoquinolin4aol
2(4chlorobenzyl)1(4hydroxy3methoxyphenyl)octahydroisoquinolin4a(2H)ol
4((4CHLOROPHENYL)METHYL)5(4HYDROXY3METHOXYPHENYL)4AZABICYCLO(440)DECAN1OL
COC1=C(C=CC(=C1)C2C3CCCCC3(CCN2CC4=CC=C(C=C4)Cl)O)O
COc1cc(ccc1O)(C@@H)1N(CC(C@@)2((C@H)1CCCC2)O)Cc1ccc(cc1)Cl
InChI=1SC23H28ClNO3c128211417(71020(21)26)22194231123(1927)121325(22)15165818(24)9616h5101419222627H24111315H21H3
MFCD04179482
ZINC000002213509
ZINC000015023407
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