Vitas-M small molecule compound
methyl (1S,4aR,5S)-5-[2-(2-{[(2-hydroxyethyl)amino]methyl}furan-3-yl)ethyl]-1,4a-dimethyl-6-methylidenedecahydronaphthalene-1-carboxylate
Catalog ID
STL526300
SMILES OCCNCc1occc1CC[C@H]1C(=C)CCC2[C@]1(C)CCC[C@]2(C)C(=O)OC
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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 C24H37NO4 MW 403.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H37NO4/c1-17-6-9-21-23(2,11-5-12-24(21,3)22(27)28-4)19(17)8-7-18-10-15-29-20(18)16-25-13-14-26/h10,15,19,21,25-26H,1,5-9,11-14,16H2,2-4H3/t19-,21?,23+,24-/m0/s1InChIKey
JREAFELZSSHHGP-PBBOVNIRSA-NSynonyms
(1S4aR5S)methyl5(2(2(((2hydroxyethyl)amino)methyl)furan3yl)ethyl)14adimethyl6methylenedecahydronaphthalene1carboxylatehydrochloride
15454447
InChI=1SC24H37NO4c117692123(21151224(213)22(27)284)19(17)871810152920(18)1625131426h101519212526H159111416H224H3t1921?23+24m0s1
methyl(1~(S)4~(a)~(R)5~(S))5(2(2((2hydroxyethylamino)methyl)furan3yl)ethyl)14~(a)dimethyl6methylidene345788~(a)hexahydro2~(H)naphthalene1carboxylate
methyl(1S4aR5S)5(2(2(((2hydroxyethyl)amino)methyl)furan3yl)ethyl)14adimethyl6methylidenedecahydronaphthalene1carboxylate
MFCD02925184
OCCNCc1occc1CC(C@H)1C(=C)CCC2(C@)1(C)CCC(C@)2(C)C(=O)OCCl
ZINC000004028838
ZINC000004028839
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