Vitas-M small molecule compound
(2E)-1-{1-[4-(diethylamino)phenyl]-4a-hydroxyoctahydroisoquinolin-2(1H)-yl}-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
Catalog ID
STL512291
SMILES CCN(c1ccc(cc1)C1N(CCC2(C1CCCC2)O)C(=O)/C=C/c1cc(OC)c(c(c1)OC)OC)CC
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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 C31H42N2O5 MW 522.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H42N2O5/c1-6-32(7-2)24-14-12-23(13-15-24)29-25-10-8-9-17-31(25,35)18-19-33(29)28(34)16-11-22-20-26(36-3)30(38-5)27(21-22)37-4/h11-16,20-21,25,29,35H,6-10,17-19H2,1-5H3/b16-11+InChIKey
UYBVBFZQKLNELJ-LFIBNONCSA-NSynonyms
(~(E))1(1(4(diethylamino)phenyl)4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)3(345trimethoxyphenyl)prop2en1one
(2E)1(1(4(diethylamino)phenyl)4ahydroxyoctahydroisoquinolin2(1H)yl)3(345trimethoxyphenyl)prop2en1one
(2E)1(2(4(DIETHYLAMINO)PHENYL)6HYDROXY3AZABICYCLO(440)DEC3YL)3(345TRIMETHOXYPHENYL)PROP2EN1ONE
(E)1((1R)1(4(diethylamino)phenyl)4ahydroxyoctahydroisoquinolin2(1H)yl)3(345trimethoxyphenyl)prop2en1one
5906246
CCN(c1ccc(cc1)(C@@H)1N(CCC2(C1CCCC2)O)C(=O)C=Cc1cc(OC)c(c(c1)OC)OC)CC
InChI=1SC31H42N2O5c1632(72)24141223(131524)292510891731(2535)181933(29)28(34)1611222026(363)30(385)27(2122)374h11162021252935H6101719H215H3b1611+
MFCD04145227
ZINC000002157163
ZINC000016031716
Check stock
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Check stock on Vitas-MAvailable files
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