Vitas-M small molecule compound
2-(4-methylbenzyl)-1-(3,4,5-trimethoxyphenyl)octahydroisoquinolin-4a(2H)-ol
Catalog ID
STL175170
SMILES COc1cc(cc(c1OC)OC)C1N(CCC2(C1CCCC2)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 C26H35NO4 MW 425.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H35NO4/c1-18-8-10-19(11-9-18)17-27-14-13-26(28)12-6-5-7-21(26)24(27)20-15-22(29-2)25(31-4)23(16-20)30-3/h8-11,15-16,21,24,28H,5-7,12-14,17H2,1-4H3InChIKey
UWRQLAGOUKFNKV-UHFFFAOYSA-NSynonyms
1212272-20-2(1R)2(4methylbenzyl)1(345trimethoxyphenyl)decahydroisoquinolin4aol
1212272202
2((4methylphenyl)methyl)1(345trimethoxyphenyl)13456788aoctahydroisoquinolin4aol
2(4methylbenzyl)1(345trimethoxyphenyl)octahydroisoquinolin4a(2H)ol
CC1=CC=C(C=C1)CN2CCC3(CCCCC3C2C4=CC(=C(C(=C4)OC)OC)OC)O
COc1cc(cc(c1OC)OC)(C@@H)1N(CCC2(C1CCCC2)O)Cc1ccc(cc1)C
InChI=1SC26H35NO4c11881019(11918)1727141326(28)1265721(26)24(27)201522(292)25(314)23(1620)303h8111516212428H57121417H214H3
MFCD04146365
ZINC000002106299
ZINC000248120182
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