Products 2226894-58-0

CAS 2226894-58-0 appears in our catalog under these names: PSMA–1007, 5-(((S)-4-Carboxy-1-(((S)-4-carboxy-1-((4-(((S)-1-(((S)-5-carboxy-5-(3-((S)-1,3-dicarboxypropyl)ureido)pentyl)amino)-3-(naphthalen-2-yl)-1-oxopropan-2-yl)carbamoyl)benzyl)amino)-1-oxobutan-2-yl)amino)-1-oxobutan-2-yl)carbamoyl)-N,N,N-trimethylpyridin-2-aminium 2,2,2-trifluoroacetate, 95%, 95%, PSMA-1007, 99.35%. Offered by: GLPBio, Chemat, MedChemExpress. Available pack sizes: 1mg, 10mg, 5mg, 100mg, 250mg, 1g, 10 mg, 5 mg.

Structural formula: {0} (CAS {1})

[5-[[(2S)-4-carboxy-1-[[(2S)-4-carboxy-1-[[4-[[(2S)-1-[[(5S)-5-carboxy-5-[[(1S)-1,3-dicarboxypropyl]carbamoylamino]pentyl]amino]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]phenyl]methylamino]-1-oxobutan-2-yl]amino]-1-oxobutan-2-yl]carbamoyl]-2-pyridinyl]-trimethylazanium;2,2,2-trifluoroacetate (CAS 2226894-58-0) is a chemical compound with the molecular formula C54H64F3N9O18 and a molecular weight of 1184.1 g/mol. IUPAC name: [5-[[(2S)-4-carboxy-1-[[(2S)-4-carboxy-1-[[4-[[(2S)-1-[[(5S)-5-carboxy-5-[[(1S)-1,3-dicarboxypropyl]carbamoylamino]pentyl]amino]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]phenyl]methylamino]-1-oxobutan-2-yl]amino]-1-oxobutan-2-yl]carbamoyl]-2-pyridinyl]-trimethylazanium;2,2,2-trifluoroacetate. InChIKey: QQFSTGSNRLIZGD-ACXPFIKISA-N.

Identity
Molecular formulaC54H64F3N9O18
Molecular weight1184.1 g/mol
IUPAC name[5-[[(2S)-4-carboxy-1-[[(2S)-4-carboxy-1-[[4-[[(2S)-1-[[(5S)-5-carboxy-5-[[(1S)-1,3-dicarboxypropyl]carbamoylamino]pentyl]amino]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]phenyl]methylamino]-1-oxobutan-2-yl]amino]-1-oxobutan-2-yl]carbamoyl]-2-pyridinyl]-trimethylazanium;2,2,2-trifluoroacetate
InChIKeyQQFSTGSNRLIZGD-ACXPFIKISA-N
SMILESC[N+](C)(C)C1=NC=C(C=C1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC2=CC=C(C=C2)C(=O)N[C@@H](CC3=CC4=CC=CC=C4C=C3)C(=O)NCCCC[C@@H](C(=O)O)NC(=O)N[C@@H](CCC(=O)O)C(=O)O.C(=O)(C(F)(F)F)[O-]

Computed by PubChem (NCBI)

Synonyms: orb1785986