Vitas-M small molecule compound
(2'R,3S,3aR,8aR,9aR)-8a-methyl-3-(((2-(piperidin-1-yl)ethyl)amino)methyl)decahydro-2H-spiro[naphtho[2,3-b]furan-5,2'-oxiran]-2-one
Catalog ID
STL526179
SMILES O=C1O[C@H]2[C@@H](C1CNCCN1CCCCC1)CC1[C@](C2)(C)CCC[C@]21OC2
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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 C22H36N2O3 MW 376.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H36N2O3/c1-21-6-5-7-22(15-26-22)19(21)12-16-17(20(25)27-18(16)13-21)14-23-8-11-24-9-3-2-4-10-24/h16-19,23H,2-15H2,1H3/t16-,17?,18-,19?,21-,22+/m1/s1InChIKey
GNGIVEBRQHHLDI-SSTXCNGPSA-NSynonyms
956956-39-1(2R3S3aR8aR9aR)8amethyl3(((2(piperidin1yl)ethyl)amino)methyl)decahydro2Hspiro(naphtho(23b)furan52oxiran)2one
(3~(a)~(R)5~(R)8~(a)~(R)9~(a)~(R))8~(a)methyl3((2piperidin1ylethylamino)methyl)spiro(3~(a)44~(a)67899~(a)octahydro3~(H)benzo(f)(1)benzofuran52oxirane)2one
16396926
956956391
InChI=1SC22H36N2O3c12165722(152622)19(21)121617(20(25)2718(16)1321)14238112493241024h161923H215H21H3t1617?1819?2122+m1s1
O=C1O(C@H)2(C@@H)(C1CNCCN1CCCCC1)CC1(C@)(C2)(C)CCC(C@)21OC2
ZINC000020112032
ZINC000020112039
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