Vitas-M small molecule compound
(12bS)-2-(3,4-dimethoxybenzyl)-9-methoxy-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537896
SMILES COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(CC3=O)Cc1ccc(c(c1)OC)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 C25H27N3O5 MW 449.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O5/c1-25-23-17(18-12-16(31-2)6-7-19(18)26-23)9-10-28(25)22(29)14-27(24(25)30)13-15-5-8-20(32-3)21(11-15)33-4/h5-8,11-12,26H,9-10,13-14H2,1-4H3/t25-/m0/s1InChIKey
YAQHLYJGYCKSMK-VWLOTQADSA-NSynonyms
956211-52-2(12bS)2(34dimethoxybenzyl)9methoxy12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(2~(S))4((34dimethoxyphenyl)methyl)13methoxy2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)11(16)1214tetraene36dione
(S)2(34dimethoxybenzyl)9methoxy12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
6570033
956211522
COc1ccc2c(c1)c1CCN3(C@)(c1(nH)2)(C)C(=O)N(CC3=O)Cc1ccc(c(c1)OC)OC
InChI=1SC25H27N3O5c1252317(181216(312)6719(18)2623)91028(25)22(29)1427(24(25)30)13155820(323)21(1115)334h58111226H9101314H214H3t25m0s1
MFCD04146388
ZINC000008917948
ZINC8917948
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