Vitas-M small molecule compound
(12bS)-9-methoxy-12b-methyl-2-(3-phenylpropyl)-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537732
SMILES COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(CC3=O)CCCc1ccccc1
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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 C25H27N3O3 MW 417.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O3/c1-25-23-19(20-15-18(31-2)10-11-21(20)26-23)12-14-28(25)22(29)16-27(24(25)30)13-6-9-17-7-4-3-5-8-17/h3-5,7-8,10-11,15,26H,6,9,12-14,16H2,1-2H3/t25-/m0/s1InChIKey
DTBHUAYNBPTNJN-VWLOTQADSA-NSynonyms
956798-71-3(12bS)9methoxy12bmethyl2(3phenylpropyl)23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(2~(S))13methoxy2methyl4(3phenylpropyl)4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)11(16)1214tetraene36dione
(S)9methoxy12bmethyl2(3phenylpropyl)2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
6570983
956798713
COc1ccc2c(c1)c1CCN3(C@)(c1(nH)2)(C)C(=O)N(CC3=O)CCCc1ccccc1
InChI=1SC25H27N3O3c1252319(201518(312)101121(20)2623)121428(25)22(29)1627(24(25)30)1369177435817h357810111526H69121416H212H3t25m0s1
MFCD05671557
ZINC000004073488
ZINC4073488
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