Vitas-M small molecule compound
2-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)pentanedioic acid
Catalog ID
STL349483
SMILES OC(=O)C(n1c(=O)c2cccc3c2c(c1=O)ccc3)CCC(=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 C17H13NO6 MW 327.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13NO6/c19-13(20)8-7-12(17(23)24)18-15(21)10-5-1-3-9-4-2-6-11(14(9)10)16(18)22/h1-6,12H,7-8H2,(H,19,20)(H,23,24)InChIKey
HKYKAZUBQBKDEX-UHFFFAOYSA-NSynonyms
202745-98-02(13dioxo1Hbenzo(de)isoquinolin2(3H)yl)pentanedioicacid
2(13DIOXOBENZO(DE)ISOQUINOLIN2YL)PENTANEDIOICACID
202745980
C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC=C2)C(CCC(=O)O)C(=O)O
InChI=1SC17H13NO6c1913(20)8712(17(23)24)1815(21)10513942611(14(9)10)16(18)22h1612H78H2(H1920)(H2324)
MFCD00181324
ZINC000004031489
ZINC000004031490
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