Vitas-M small molecule compound
(3S,3aR,5S,8aR,9aR)-5,8a-dimethyl-3-((methyl(2-(pyridin-2-yl)ethyl)amino)methyl)-3,3a,6,7,8,8a,9,9a-octahydronaphtho[2,3-b]furan-2(5H)-one
Catalog ID
STL526271
SMILES CN(CC1C(=O)O[C@H]2[C@@H]1C=C1[C@@H](C)CCC[C@@]1(C2)C)CCc1ccccn1
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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 C23H32N2O2 MW 368.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H32N2O2/c1-16-7-6-10-23(2)14-21-18(13-20(16)23)19(22(26)27-21)15-25(3)12-9-17-8-4-5-11-24-17/h4-5,8,11,13,16,18-19,21H,6-7,9-10,12,14-15H2,1-3H3/t16-,18+,19?,21+,23+/m0/s1InChIKey
WKHUDKYPKFTYKS-NZOGGUBZSA-NSynonyms
956975-89-6(3~(a)~(R)5~(S)8~(a)~(R)9~(a)~(R))58~(a)dimethyl3((methyl(2pyridin2ylethyl)amino)methyl)33~(a)567899~(a)octahydrobenzo(f)(1)benzofuran2one
(3S3aR5S8aR9aR)58adimethyl3((methyl(2(pyridin2yl)ethyl)amino)methyl)33a6788a99aoctahydronaphtho(23b)furan2(5H)one
16397026
956975896
CN(CC1C(=O)O(C@H)2(C@@H)1C=C1(C@@H)(C)CCC(C@@)1(C2)C)CCc1ccccn1
InChI=1SC23H32N2O2c116761023(2)142118(1320(16)23)19(22(26)2721)1525(3)12917845112417h458111316181921H67910121415H213H3t1618+19?21+23+m0s1
MFCD32649826
ZINC000003999464
ZINC000012659878
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