Vitas-M small molecule compound

methyl 3-[(12aS)-1,4-dioxo-3,4,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indol-2(1H)-yl]propanoate

Catalog ID
STL539245
SMILES COC(=O)CCN1CC(=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 C18H19N3O4 MW 341.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O4/c1-25-17(23)6-7-20-10-16(22)21-9-14-12(8-15(21)18(20)24)11-4-2-3-5-13(11)19-14/h2-5,15,19H,6-10H2,1H3/t15-/m0/s1
InChIKey
NFCLBXNXUXTUIW-HNNXBMFYSA-N
Synonyms
956968-13-1
(S)methyl3(14dioxo341212atetrahydropyrazino(1216)pyrido(34b)indol2(1H6H7H)yl)propanoate
16407749
956968131
COC(=O)CCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2)(nH)c2c1cccc2
InChI=1SC18H19N3O4c12517(23)67201016(22)2191412(815(21)18(20)24)11423513(11)1914h251519H610H21H3t15m0s1
methyl3((12aS)14dioxo34671212ahexahydropyrazino(1216)pyrido(34b)indol2(1H)yl)propanoate
methyl3((8~(S))47dioxo3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraen6yl)propanoate
ZINC000008879775
ZINC8879775

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Available files

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