Vitas-M small molecule compound
(12aS)-2-(furan-2-ylmethyl)-6-[4-(propan-2-yl)phenyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL548885
SMILES O=C1CN(Cc2ccco2)C(=O)[C@H]2N1C(c1ccc(cc1)C(C)C)c1c(C2)c2c([nH]1)cccc2
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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 C28H27N3O3 MW 453.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O3/c1-17(2)18-9-11-19(12-10-18)27-26-22(21-7-3-4-8-23(21)29-26)14-24-28(33)30(16-25(32)31(24)27)15-20-6-5-13-34-20/h3-13,17,24,27,29H,14-16H2,1-2H3/t24-,27?/m0/s1InChIKey
KNIZGKMBXSQBRX-BXXZMZEQSA-NSynonyms
957032-15-4(12aS)2(furan2ylmethyl)6(4(propan2yl)phenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2(furan2ylmethyl)6(4isopropylphenyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))6(furan2ylmethyl)2(4propan2ylphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16398565
957032154
InChI=1SC28H27N3O3c117(2)1891119(121018)272622(21734823(21)2926)142428(33)30(1625(32)31(24)27)152065133420h31317242729H1416H212H3t2427?m0s1
MFCD03661910
ZINC000002091861
ZINC000002091862
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