Vitas-M small molecule compound
(1R,4aS,8aS)-1-(3,4-dimethoxyphenyl)-2-(4-methylbenzyl)octahydroisoquinolin-4a(2H)-ol
Catalog ID
STL547288
SMILES COc1cc(ccc1OC)[C@@H]1N(CC[C@@]2([C@H]1CCCC2)O)Cc1ccc(cc1)C
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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 C25H33NO3 MW 395.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33NO3/c1-18-7-9-19(10-8-18)17-26-15-14-25(27)13-5-4-6-21(25)24(26)20-11-12-22(28-2)23(16-20)29-3/h7-12,16,21,24,27H,4-6,13-15,17H2,1-3H3/t21-,24-,25-/m0/s1InChIKey
QZYSXKPKTXYODP-TUSQITKMSA-NSynonyms
956239-26-2(1~(R)4~(a)~(S)8~(a)~(S))1(34dimethoxyphenyl)2((4methylphenyl)methyl)13456788~(a)octahydroisoquinolin4~(a)ol
(1R)1(34dimethoxyphenyl)2(4methylbenzyl)decahydroisoquinolin4aol
(1R4aS8aS)1(34dimethoxyphenyl)2(4methylbenzyl)octahydroisoquinolin4a(2H)ol
11875248
956239262
COc1cc(ccc1OC)(C@@H)1N(CCC2(C1CCCC2)O)Cc1ccc(cc1)C
InChI=1SC25H33NO3c1187919(10818)1726151425(27)1354621(25)24(26)20111222(282)23(1620)293h71216212427H46131517H213H3t212425m0s1
MFCD06764398
ZINC000004062062
ZINC4062062
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