Vitas-M small molecule compound

4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)butanoic acid

Catalog ID
STK788488
SMILES OC(=O)CCCN1C(=O)C2C(C1=O)C1CC2C=C1

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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 C13H15NO4 MW 249.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15NO4/c15-9(16)2-1-5-14-12(17)10-7-3-4-8(6-7)11(10)13(14)18/h3-4,7-8,10-11H,1-2,5-6H2,(H,15,16)
InChIKey
WGPBWBNVJMUVEK-UHFFFAOYSA-N
Synonyms
377767-35-6
377767356
4(13dioxo133a477ahexahydro2H47methanoisoindol2yl)butanoicacid
4(13dioxo3a477atetrahydro1H47methanoisoindol2(3H)yl)butanoicacid
C1C2C=CC1C3C2C(=O)N(C3=O)CCCC(=O)O
InChI=1SC13H15NO4c159(16)2151412(17)107348(67)11(10)13(14)18h34781011H1256H2(H1516)
MFCD01949572
ZINC000100279147
ZINC000100768010

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.