Vitas-M small molecule compound
(3a'R,5'R,5a'S,8a'S,8b'R)-5'-{[(4-ethoxybenzyl)oxy]methyl}tetrahydro-3a'H-dispiro[cyclohexane-1,2'-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-7',1''-cyclohexane] (non-preferred name)
Catalog ID
STL570131
SMILES CCOc1ccc(cc1)COC[C@H]1O[C@@H]2OC3(O[C@@H]2[C@@H]2[C@H]1OC1(O2)CCCCC1)CCCCC3
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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 C27H38O7 MW 474.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H38O7/c1-2-29-20-11-9-19(10-12-20)17-28-18-21-22-23(32-26(31-22)13-5-3-6-14-26)24-25(30-21)34-27(33-24)15-7-4-8-16-27/h9-12,21-25H,2-8,13-18H2,1H3/t21-,22+,23+,24-,25-/m1/s1InChIKey
NPEVIEODXXWXPX-ZLOLNMDISA-NSynonyms
300799-06-8(1S2R6R8R9S)8(((4ethoxyphenyl)methoxy)methyl)dispiro(cyclohexane14(3571012)pentaoxatricyclo(7300^(26))dodecane111cyclohexane)
(3aR5R5aS8aS8bR)5(((4ethoxybenzyl)oxy)methyl)tetrahydro3aHdispiro(cyclohexane12bis(13)dioxolo(45b45d)pyran71cyclohexane)(nonpreferredname)
16397506
1OCTYL1HBENZO(D)IMIDAZOLE
1OCTYL1HBENZOIMIDAZOLE
1OCTYLBENZIMIDAZOLE
300799068
CCOc1ccc(cc1)COC(C@H)1O(C@@H)2OC3(O(C@@H)2(C@@H)2(C@H)1OC1(O2)CCCCC1)CCCCC3
InChI=1SC15H22N2c1234569121713161410781115(14)17h78101113H26912H21H3
ZINC000008833993
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