Vitas-M small molecule compound
(3S,3aR,8aR,9aR)-3-((4-(4-chlorophenyl)-5,6-dihydropyridin-1(2H)-yl)methyl)-8a-methyl-5-methylenedecahydronaphtho[2,3-b]furan-2(3H)-one
Catalog ID
STL533010
SMILES O=C1O[C@H]2[C@@H](C1CN1CCC(=CC1)c1ccc(cc1)Cl)CC1[C@](C2)(C)CCCC1=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 C26H32ClNO2 MW 426.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32ClNO2/c1-17-4-3-11-26(2)15-24-21(14-23(17)26)22(25(29)30-24)16-28-12-9-19(10-13-28)18-5-7-20(27)8-6-18/h5-9,21-24H,1,3-4,10-16H2,2H3/t21-,22?,23?,24-,26-/m1/s1InChIKey
IUHODRMRSHJGHQ-XURSCOLFSA-NSynonyms
956972-28-4(3~(a)~(R)8~(a)~(R)9~(a)~(R))3((4(4chlorophenyl)36dihydro2~(H)pyridin1yl)methyl)8~(a)methyl5methylidene3~(a)44~(a)67899~(a)octahydro3~(H)benzo(f)(1)benzofuran2one
(3S3aR8aR9aR)3((4(4chlorophenyl)56dihydropyridin1(2H)yl)methyl)8amethyl5methylenedecahydronaphtho(23b)furan2(3H)one
16404716
956972284
InChI=1SC26H32ClNO2c117431126(2)152421(1423(17)26)22(25(29)3024)162812919(101328)185720(27)8618h592124H1341016H22H3t2122?23?2426m1s1
O=C1O(C@H)2(C@@H)(C1CN1CCC(=CC1)c1ccc(cc1)Cl)CC1(C@)(C2)(C)CCCC1=C
ZINC000004085629
ZINC000012884827
Check stock
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