Products 77739-21-0

CAS 77739-21-0 appears in our catalog under these names: β-Neoendorphin, β–Neoendorphin, Beta-Neoendorphin, Beta-Neo-Endorphin (Porcine), β-Neo-Endorphin, 98%, 98%. Offered by: Creative Peptides, GLPBio, Biosynth, Chemat, MedChemExpress. Available pack sizes: on request, 25mg, 5mg, 2000ug, 5000ug, 0,5mg, 10000ug, 1mg.

Structural formula: {0} (CAS {1})

(2S)-1-[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]hexanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carboxylic acid (CAS 77739-21-0) is a chemical compound with the molecular formula C54H77N13O12 and a molecular weight of 1100.3 g/mol. IUPAC name: (2S)-1-[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]hexanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carboxylic acid. InChIKey: RTXIYIQLESPXIV-VLOLPVCOSA-N.

Identity
Molecular formulaC54H77N13O12
Molecular weight1100.3 g/mol
IUPAC name(2S)-1-[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]hexanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carboxylic acid
InChIKeyRTXIYIQLESPXIV-VLOLPVCOSA-N
SMILESCC(C)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N2CCC[C@H]2C(=O)O)NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)CNC(=O)CNC(=O)[C@H](CC4=CC=C(C=C4)O)N

Computed by PubChem (NCBI)