Vitas-M small molecule compound
(12bS)-7-(3-ethoxy-4-propoxyphenyl)-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL533692
SMILES CCCOc1ccc(cc1OCC)C1CN2C(=O)CNC(=O)[C@@]2(c2c1c1ccccc1[nH]2)C
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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 C26H29N3O4 MW 447.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O4/c1-4-12-33-20-11-10-16(13-21(20)32-5-2)18-15-29-22(30)14-27-25(31)26(29,3)24-23(18)17-8-6-7-9-19(17)28-24/h6-11,13,18,28H,4-5,12,14-15H2,1-3H3,(H,27,31)/t18?,26-/m0/s1InChIKey
SYJPTZGNDKNRFC-IHZSNKTASA-NSynonyms
956999-70-5(12bS)7(3ethoxy4propoxyphenyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(3ethoxy4propoxyphenyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(3ethoxy4propoxyphenyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402009
956999705
CCCOc1ccc(cc1OCC)C1CN2C(=O)CNC(=O)(C@@)2(c2c1c1ccccc1(nH)2)C
InChI=1SC26H29N3O4c14123320111016(1321(20)3252)18152922(30)142725(31)26(293)2423(18)17867919(17)2824h611131828H45121415H213H3(H2731)t18?26m0s1
MFCD06492700
ZINC000012873170
ZINC000012873177
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