PDI2

cas: 3110124-60-9 — see every product listed under this CAS number, including other names

PDI2 (CAS 3110124-60-9) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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cas3110124-60-9
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Structural formula: {0} (CAS {1})

(2S)-2-[[(1S)-5-[[(2S)-2-[[4-[[[4-[7-[4-[2-(2-aminoethylamino)ethylamino]-1-carboxy-4-oxobutyl]-4,10-bis(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]-4-carboxybutanoyl]amino]methyl]cyclohexanecarbonyl]amino]-3-naphthalen-2-ylpropanoyl]amino]-1-carboxypentyl]carbamoylamino]pentanedioic acid (CAS 3110124-60-9) is a chemical compound with the molecular formula C59H90N12O19 and a molecular weight of 1271.4 g/mol. IUPAC name: (2S)-2-[[(1S)-5-[[(2S)-2-[[4-[[[4-[7-[4-[2-(2-aminoethylamino)ethylamino]-1-carboxy-4-oxobutyl]-4,10-bis(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]-4-carboxybutanoyl]amino]methyl]cyclohexanecarbonyl]amino]-3-naphthalen-2-ylpropanoyl]amino]-1-carboxypentyl]carbamoylamino]pentanedioic acid. InChIKey: BDTGBTUYXGCHTF-VKOWTPDASA-N.

Identity
Molecular formulaC59H90N12O19
Molecular weight1271.4 g/mol
IUPAC name(2S)-2-[[(1S)-5-[[(2S)-2-[[4-[[[4-[7-[4-[2-(2-aminoethylamino)ethylamino]-1-carboxy-4-oxobutyl]-4,10-bis(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]-4-carboxybutanoyl]amino]methyl]cyclohexanecarbonyl]amino]-3-naphthalen-2-ylpropanoyl]amino]-1-carboxypentyl]carbamoylamino]pentanedioic acid
InChIKeyBDTGBTUYXGCHTF-VKOWTPDASA-N
SMILESC1CC(CCC1CNC(=O)CCC(C(=O)O)N2CCN(CCN(CCN(CC2)CC(=O)O)C(CCC(=O)NCCNCCN)C(=O)O)CC(=O)O)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

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