Products 3056440-83-3

CAS 3056440-83-3 is the registry number for PSMA-D5, 98.61%. Offered by: MedChemExpress. Available pack sizes: 5 mg, 10 mg, 1 mg.

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

(2S)-2-[[(1S)-1-carboxy-5-[[3-[[(5S)-5-carboxy-5-[[(1S)-1,3-dicarboxypropyl]carbamoylamino]pentyl]carbamoyl]-5-[4-[3-[[2-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetyl]amino]propanoylamino]phenyl]benzoyl]amino]pentyl]carbamoylamino]pentanedioic acid (CAS 3056440-83-3) is a chemical compound with the molecular formula C57H80N12O24 and a molecular weight of 1317.3 g/mol. IUPAC name: (2S)-2-[[(1S)-1-carboxy-5-[[3-[[(5S)-5-carboxy-5-[[(1S)-1,3-dicarboxypropyl]carbamoylamino]pentyl]carbamoyl]-5-[4-[3-[[2-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetyl]amino]propanoylamino]phenyl]benzoyl]amino]pentyl]carbamoylamino]pentanedioic acid. InChIKey: SLWCJKNBFXBEAA-IWWWZYECSA-N.

Identity
Molecular formulaC57H80N12O24
Molecular weight1317.3 g/mol
IUPAC name(2S)-2-[[(1S)-1-carboxy-5-[[3-[[(5S)-5-carboxy-5-[[(1S)-1,3-dicarboxypropyl]carbamoylamino]pentyl]carbamoyl]-5-[4-[3-[[2-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetyl]amino]propanoylamino]phenyl]benzoyl]amino]pentyl]carbamoylamino]pentanedioic acid
InChIKeySLWCJKNBFXBEAA-IWWWZYECSA-N
SMILESC1CN(CCN(CCN(CCN1CC(=O)NCCC(=O)NC2=CC=C(C=C2)C3=CC(=CC(=C3)C(=O)NCCCC[C@@H](C(=O)O)NC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)NCCCC[C@@H](C(=O)O)NC(=O)N[C@@H](CCC(=O)O)C(=O)O)CC(=O)O)CC(=O)O)CC(=O)O

Computed by PubChem (NCBI)

Synonyms: orb2814699