Products 136553-96-3

CAS 136553-96-3 appears in our catalog under these names: JKC-301, JKC–301, JKC-301 Cyclo(-D-Asp-Pro-D-Ile-Leu-D-Trp), JKC 301. Offered by: Creative Peptides, GLPBio, Biosynth, MedChemExpress. Available pack sizes: on request, 1mg, 5mg, 1000ug, 2000ug, 5000ug, Get quote.

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)