Vitas-M small molecule compound
8-amino-2',6'-dihydroxy-3-(4-methoxyphenyl)-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-4'-one
Catalog ID
STK598909
SMILES COc1ccc(cc1)N1CCN2C(C1)C1(Cc3c2ccc(c3)N)C(=NC(=NC1=O)O)O
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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 C22H23N5O4 MW 421.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O4/c1-31-16-5-3-15(4-6-16)26-8-9-27-17-7-2-14(23)10-13(17)11-22(18(27)12-26)19(28)24-21(30)25-20(22)29/h2-7,10,18H,8-9,11-12,23H2,1H3,(H2,24,25,28,29,30)InChIKey
MRPSAKVJZBWHAN-UHFFFAOYSA-NSynonyms
8amino26dihydroxy3(4methoxyphenyl)2344atetrahydro1H4H6Hspiro(pyrazino(12a)quinoline55pyrimidin)4one
8amino3(4methoxyphenyl)spiro(13diazinane55244a6tetrahydro1Hpyrazino(12a)quinoline)246trione
COC1=CC=C(C=C1)N2CCN3C(C2)C4(CC5=C3C=CC(=C5)N)C(=O)NC(=O)NC4=O
InChI=1SC22H23N5O4c131165315(4616)268927177214(23)1013(17)1122(18(27)1226)19(28)2421(30)2520(22)29h271018H89111223H21H3(H22425282930)
MFCD18158560
ZINC000017027241
ZINC000245326869
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