DOTA-cyclo(RGDfK) acetate

cas: 909024-55-1 — see every product listed under this CAS number, including other names

DOTA-cyclo(RGDfK) acetate (CAS 909024-55-1) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Creative Peptides.

brandCreative Peptides
catalog numberCP-M34140649H
cas909024-55-1
sizeon request
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Structural formula: {0} (CAS {1})

2-[(2S,5R,8S,11S)-5-benzyl-11-[3-(diaminomethylideneamino)propyl]-3,6,9,12,15-pentaoxo-8-[4-[[2-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetyl]amino]butyl]-1,4,7,10,13-pentazacyclopentadec-2-yl]acetic acid (CAS 909024-55-1) is a chemical compound with the molecular formula C43H67N13O14 and a molecular weight of 990.1 g/mol. IUPAC name: 2-[(2S,5R,8S,11S)-5-benzyl-11-[3-(diaminomethylideneamino)propyl]-3,6,9,12,15-pentaoxo-8-[4-[[2-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetyl]amino]butyl]-1,4,7,10,13-pentazacyclopentadec-2-yl]acetic acid. InChIKey: JCMRWLZGXBWZRR-IHZBLBIESA-N.

Identity
Molecular formulaC43H67N13O14
Molecular weight990.1 g/mol
IUPAC name2-[(2S,5R,8S,11S)-5-benzyl-11-[3-(diaminomethylideneamino)propyl]-3,6,9,12,15-pentaoxo-8-[4-[[2-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetyl]amino]butyl]-1,4,7,10,13-pentazacyclopentadec-2-yl]acetic acid
InChIKeyJCMRWLZGXBWZRR-IHZBLBIESA-N
SMILESC1CN(CCN(CCN(CCN1CC(=O)NCCCC[C@H]2C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C(=O)N2)CC3=CC=CC=C3)CC(=O)O)CCCN=C(N)N)CC(=O)O)CC(=O)O)CC(=O)O

Computed by PubChem (NCBI)

Synonyms: DOTA-cyclo(RGDfK), orb2814704

Also listed as

Cyclo[L-arginylglycyl-L-α-aspartyl-D-phenylalanyl-N6-[[4,7,10-tris(carboxymethyl)-1,4,7,10-tetraazacyclododec-1-yl]acetyl]-L-lysyl], 95%, 95% Chemat CAS 909024-55-1
DOTA-cyclo(RGDfK), 99.53% MedChemExpress CAS 909024-55-1