PSMA binder-3

cas: 3049900-51-5 — see every product listed under this CAS number, including other names

PSMA binder-3 (CAS 3049900-51-5) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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catalog numberHY-161626-Get quote
cas3049900-51-5
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Structural formula: {0} (CAS {1})

(2S)-2-[[(1S)-1-carboxy-5-[(4-carboxyphenyl)methyl-[6-[[4-oxo-4-[[(2S)-1-oxo-1-[[(2S)-1-oxo-3-phenyl-1-[3-[[2-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetyl]amino]propylamino]propan-2-yl]amino]-3-phenylpropan-2-yl]amino]butanoyl]amino]hexanoyl]amino]pentyl]carbamoylamino]pentanedioic acid (CAS 3049900-51-5) is a chemical compound with the molecular formula C67H94N12O21 and a molecular weight of 1403.5 g/mol. IUPAC name: (2S)-2-[[(1S)-1-carboxy-5-[(4-carboxyphenyl)methyl-[6-[[4-oxo-4-[[(2S)-1-oxo-1-[[(2S)-1-oxo-3-phenyl-1-[3-[[2-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetyl]amino]propylamino]propan-2-yl]amino]-3-phenylpropan-2-yl]amino]butanoyl]amino]hexanoyl]amino]pentyl]carbamoylamino]pentanedioic acid. InChIKey: ZZGCEKMYLHQTPD-DLWBLUATSA-N.

Identity
Molecular formulaC67H94N12O21
Molecular weight1403.5 g/mol
IUPAC name(2S)-2-[[(1S)-1-carboxy-5-[(4-carboxyphenyl)methyl-[6-[[4-oxo-4-[[(2S)-1-oxo-1-[[(2S)-1-oxo-3-phenyl-1-[3-[[2-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetyl]amino]propylamino]propan-2-yl]amino]-3-phenylpropan-2-yl]amino]butanoyl]amino]hexanoyl]amino]pentyl]carbamoylamino]pentanedioic acid
InChIKeyZZGCEKMYLHQTPD-DLWBLUATSA-N
SMILESC1CN(CCN(CCN(CCN1CC(=O)NCCCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)CCC(=O)NCCCCCC(=O)N(CCCC[C@@H](C(=O)O)NC(=O)N[C@@H](CCC(=O)O)C(=O)O)CC4=CC=C(C=C4)C(=O)O)CC(=O)O)CC(=O)O)CC(=O)O

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