Vitas-M small molecule compound
(3S,3aR,4aS,8aR,9aR)-3-((4-(2-(2-hydroxyethoxy)ethyl)piperazin-1-yl)methyl)-8a-methyl-5-methylenedecahydronaphtho[2,3-b]furan-2(3H)-one oxalate
Catalog ID
STL528628
SMILES OCCOCCN1CCN(CC1)CC1C(=O)O[C@H]2[C@@H]1C[C@H]1C(=C)CCC[C@@]1(C2)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 C23H38N2O4 MW 406.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H38N2O4/c1-17-4-3-5-23(2)15-21-18(14-20(17)23)19(22(27)29-21)16-25-8-6-24(7-9-25)10-12-28-13-11-26/h18-21,26H,1,3-16H2,2H3/t18-,19?,20+,21-,23-/m1/s1InChIKey
DCMSSKJGUVGMJI-YWJDPIHNSA-NSynonyms
(3~(a)~(R)4~(a)~(S)8~(a)~(R)9~(a)~(R))3((4(2(2hydroxyethoxy)ethyl)piperazin1yl)methyl)8~(a)methyl5methylidene3~(a)44~(a)67899~(a)octahydro3~(H)benzo(f)(1)benzofuran2one
(3S3aR4aS8aR9aR)3((4(2(2hydroxyethoxy)ethyl)piperazin1yl)methyl)8amethyl5methylenedecahydronaphtho(23b)furan2(3H)oneoxalate
16400079
InChI=1SC23H38N2O4c11743523(2)152118(1420(17)23)19(22(27)2921)16258624(7925)101228131126h182126H1316H22H3t1819?20+2123m1s1
MFCD32649890
OC(=O)C(=O)OOCCOCCN1CCN(CC1)CC1C(=O)O(C@H)2(C@@H)1C(C@H)1C(=C)CCC(C@@)1(C2)C
ZINC000020412674
ZINC000020412677
Check stock
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