Disomotide

Base Information

• Chemical Name: Disomotide
• CAS No.: 181477-43-0
• Molecular Formula: C47H74N10O14S
• Molecular Weight: 1035.21
• DSSTox Substance ID: DTXSID50171158
• Wikidata: Q27269103
• NCI Thesaurus Code: C76227
• ChEMBL ID: CHEMBL263429
• Mol file: 181477-43-0.mol

Synonyms:Disomotide;181477-43-0;Disomotide [USAN:INN];UNII-8028PPX4PM;MPS 22;MPS-22;8028PPX4PM;(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-4-methylsulfanylbutanoyl]amino]-3-carboxypropanoyl]amino]-5-oxopentanoyl]amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]amino]-3-hydroxypropanoyl]amino]-3-methylbutanoic acid;(186-L-Methionine)melanocyte protein Pmel 17 (human melanoma-associated ME20 antigen)-(185-193)-peptide;L-Valine, L-isoleucyl-L-methionyl-L-alpha-aspartyl-L-glutaminyl-L-valyl-L-prolyl-L- phenylalanyl-L-seryl-;CHEMBL263429;DTXSID50171158;BDBM50409410;Gp100:209-217(210m) peptide;Gp-100:209-217(210m) peptide;Q27269103

Chemical Property of Disomotide

Chemical Property:

• Boiling Point: 1450.7 °C at 760 mmHg
• Flash Point: 831.1 °C
• PSA: 413.25000
• Density: 1.291 g/cm³
• LogP: 1.94410
• XLogP3: -2.3
• Hydrogen Bond Donor Count: 12
• Hydrogen Bond Acceptor Count: 16
• Rotatable Bond Count: 31
• Exact Mass: 1034.51066825
• Heavy Atom Count: 72
• Complexity: 1900

Purity/Quality:

98%min ^*data from raw suppliers

G209-2M (209-217) 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)C(C(=O)NC(CCSC)C(=O)NC(CC(=O)O)C(=O)NC(CCC(=O)N)C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC(CC2=CC=CC=C2)C(=O)NC(CO)C(=O)NC(C(C)C)C(=O)O)N
• Isomeric SMILES: CC[C@H](C)[C@@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CO)C(=O)N[C@@H](C(C)C)C(=O)O)N
• Uses: Melanoma peptide vaccine.