Vitas-M small molecule compound

(12aR)-2-(2-hydroxy-2-phenylethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione

Catalog ID
STL527972
SMILES OC(c1ccccc1)CN1CC(=O)N2[C@@H](C1=O)Cc1c(C2)[nH]c2c1cccc2

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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 C22H21N3O3 MW 375.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O3/c26-20(14-6-2-1-3-7-14)12-24-13-21(27)25-11-18-16(10-19(25)22(24)28)15-8-4-5-9-17(15)23-18/h1-9,19-20,23,26H,10-13H2/t19-,20?/m1/s1
InChIKey
OULTVDXVOBAJKG-FIWHBWSRSA-N
Synonyms

(12aR)2(2hydroxy2phenylethyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2(2hydroxy2phenylethyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(R))6(2hydroxy2phenylethyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
135639346
InChI=1SC22H21N3O3c2620(146213714)12241321(27)25111816(1019(25)22(24)28)15845917(15)2318h1919202326H1013H2t1920?m1s1
MFCD03661821
OC(c1ccccc1)CN1CC(=O)N2(C@H)(C1=O)Cc1c(C2)(nH)c2c1cccc2
ZINC000002095135
ZINC000002095136

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Available files

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