Products 1546983-27-0

CAS 1546983-27-0 is the registry number for (Cys(S)²)–Octreotide. Offered by: GLPBio. Available pack sizes: 10mg, 5mg.

(Cys(S)²)–Octreotide
GLPBio
  • size: 10mg, 5mg
  • Variants: 2
from 11419.29
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Structural formula: {0} (CAS {1})

(5R,8S,11S,14R,17S,20R)-11-(4-aminobutyl)-20-[[(2R)-2-amino-3-phenylpropanoyl]amino]-17-benzyl-N-[(2R,3R)-1,3-dihydroxybutan-2-yl]-8-[(1R)-1-hydroxyethyl]-14-(1H-indol-3-ylmethyl)-7,10,13,16,19-pentaoxo-1,2,3-trithia-6,9,12,15,18-pentazacyclohenicosane-5-carboxamide (CAS 1546983-27-0) is a chemical compound with the molecular formula C49H66N10O10S3 and a molecular weight of 1051.3 g/mol. IUPAC name: (5R,8S,11S,14R,17S,20R)-11-(4-aminobutyl)-20-[[(2R)-2-amino-3-phenylpropanoyl]amino]-17-benzyl-N-[(2R,3R)-1,3-dihydroxybutan-2-yl]-8-[(1R)-1-hydroxyethyl]-14-(1H-indol-3-ylmethyl)-7,10,13,16,19-pentaoxo-1,2,3-trithia-6,9,12,15,18-pentazacyclohenicosane-5-carboxamide. InChIKey: WNMISJOLPBDMKV-OULOTJBUSA-N.

Identity
Molecular formulaC49H66N10O10S3
Molecular weight1051.3 g/mol
IUPAC name(5R,8S,11S,14R,17S,20R)-11-(4-aminobutyl)-20-[[(2R)-2-amino-3-phenylpropanoyl]amino]-17-benzyl-N-[(2R,3R)-1,3-dihydroxybutan-2-yl]-8-[(1R)-1-hydroxyethyl]-14-(1H-indol-3-ylmethyl)-7,10,13,16,19-pentaoxo-1,2,3-trithia-6,9,12,15,18-pentazacyclohenicosane-5-carboxamide
InChIKeyWNMISJOLPBDMKV-OULOTJBUSA-N
SMILESC[C@H]([C@H]1C(=O)N[C@@H](CSSSC[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N1)CCCCN)CC2=CNC3=CC=CC=C32)CC4=CC=CC=C4)NC(=O)[C@@H](CC5=CC=CC=C5)N)C(=O)N[C@H](CO)[C@@H](C)O)O

Computed by PubChem (NCBI)

Synonyms: Octreotide EP Impurity E, Octreotide Impurity 37, (Cys(S)?)-Octreotide trifluoroacetate