JKC-301

cas: 136553-96-3 — see every product listed under this CAS number, including other names

JKC-301 (CAS 136553-96-3) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Creative Peptides.

brandCreative Peptides
catalog numberCP-E09039
cas136553-96-3
sizeon request
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Structural formula: {0} (CAS {1})

2-[(3R,6R,9S,12R,15S)-12-[(2S)-butan-2-yl]-6-(1H-indol-3-ylmethyl)-9-(2-methylpropyl)-2,5,8,11,14-pentaoxo-1,4,7,10,13-pentazabicyclo[13.3.0]octadecan-3-yl]acetic acid (CAS 136553-96-3) is a chemical compound with the molecular formula C32H44N6O7 and a molecular weight of 624.7 g/mol. IUPAC name: 2-[(3R,6R,9S,12R,15S)-12-[(2S)-butan-2-yl]-6-(1H-indol-3-ylmethyl)-9-(2-methylpropyl)-2,5,8,11,14-pentaoxo-1,4,7,10,13-pentazabicyclo[13.3.0]octadecan-3-yl]acetic acid. InChIKey: KHRTUHCOJNQEQG-CSXHVWADSA-N.

Identity
Molecular formulaC32H44N6O7
Molecular weight624.7 g/mol
IUPAC name2-[(3R,6R,9S,12R,15S)-12-[(2S)-butan-2-yl]-6-(1H-indol-3-ylmethyl)-9-(2-methylpropyl)-2,5,8,11,14-pentaoxo-1,4,7,10,13-pentazabicyclo[13.3.0]octadecan-3-yl]acetic acid
InChIKeyKHRTUHCOJNQEQG-CSXHVWADSA-N
SMILESCC[C@H](C)[C@@H]1C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N2CCC[C@H]2C(=O)N1)CC(=O)O)CC3=CNC4=CC=CC=C43)CC(C)C

Computed by PubChem (NCBI)

Synonyms: Cyclo(D-alpha-aspartyl-L-prolyl-D-isoleucyl-L-leucyl-D-tryptophyl), Cyclo(D-alloisoleucyl-L-leucyl-D-tryptophyl-D-alpha-aspartyl-L-prolyl)
Isomers (same molecular formula)
4-[5-[2-[4-[5-[bis(2-hydroxyethyl)amino]-1-methylbenzimidazol-2-yl]butanoyloxy]ethyl-(2-hydroxyethyl)amino]-1-methylbenzimidazol-2-yl]butanoic acid C32H44N6O7

Also listed as

JKC–301 GLPBio CAS 136553-96-3
JKC-301 Cyclo(-D-Asp-Pro-D-Ile-Leu-D-Trp) Biosynth CAS 136553-96-3
JKC 301 MedChemExpress CAS 136553-96-3