Vitas-M small molecule compound
2'-hydroxy-13-methyl-1'-pentyl-1,2,3,4,5,5a-hexahydro-4'H,7H,8H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[1,2-a]azepine-6,5'-pyrimidine]-4',6',8(1'H)-trione
Catalog ID
STK593338
SMILES CCCCCN1C(=NC(=O)C2(C1=O)Cc1c(N3C2CCCCC3)nc2n(c1=O)cccc2C)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 C25H31N5O4 MW 465.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N5O4/c1-3-4-7-13-30-23(33)25(22(32)27-24(30)34)15-17-20(28-12-8-5-6-11-18(25)28)26-19-16(2)10-9-14-29(19)21(17)31/h9-10,14,18H,3-8,11-13,15H2,1-2H3,(H,27,32,34)InChIKey
DXTQZHYOQPSRLT-UHFFFAOYSA-NSynonyms
879446-91-02hydroxy13methyl1pentyl123455ahexahydro4H7H8Hspiro(pyrido(1212)pyrimido(5456)pyrido(12a)azepine65pyrimidine)468(1H)trione
879446910
CCCCCN1C(=O)C2(CC3=C(N=C4C(=CC=CN4C3=O)C)N5C2CCCCC5)C(=O)NC1=O
InChI=1SC25H31N5O4c1347133023(33)25(22(32)2724(30)34)151720(28128561118(25)28)261916(2)1091429(19)21(17)31h9101418H38111315H212H3(H273234)
MFCD07206109
ZINC000009332219
ZINC000229888477
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