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CHEBI:137986 - (β-Asp-Arg)n zwitterion

ChEBI IDCHEBI:137986
ChEBI Name(β-Asp-Arg)n zwitterion
Stars
ASCII Name(beta-Asp-Arg)n zwitterion
DefinitionA zwitterion derived from (β-Asp-Arg)n. Major microspecies at pH 7.3.
Last Modified29 September 2017
SubmitterAnne Morgat
DownloadsMolfile
Formula(C10H17N5O4)n.C20H36N10O9
Net Charge0
Average Mass831.846
Monoisotopic Mass831.39473
SMILESNC(=[NH2+])NCCC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCCNC(N)=[NH2+])C(=O)[O-])NC(=O)[C@@H]([NH3+])CC(=O)N[C@@H](CCCNC(N)=[NH2+])C(=O)[O-])C(=O)[O-])C(=O)[O-]
InChIInChI=1S/C30H53N15O13/c31-13(10-19(46)41-14(24(51)52)4-1-7-38-28(32)33)22(49)44-17(11-20(47)42-15(25(53)54)5-2-8-39-29(34)35)23(50)45-18(27(57)58)12-21(48)43-16(26(55)56)6-3-9-40-30(36)37/h13-18H,1-12,31H2,(H,41,46)(H,42,47)(H,43,48)(H,44,49)(H,45,50)(H,51,52)(H,53,54)(H,55,56)(H,57,58)(H4,32,33,38)(H4,34,35,39)(H4,36,37,40)/t13-,14-,15-,16-,17-,18-/m0/s1
InChIKeySHZNCSVWZLZUED-QQCJEOGWSA-N
ChEBI Ontology
Outgoing Relation(s)
(β-Asp-Arg)n zwitterion (CHEBI:137986) is a zwitterion (CHEBI:27369)
(β-Asp-Arg)n zwitterion (CHEBI:137986) is tautomer of cyanophycin macromolecule (CHEBI:65318)
Incoming Relation(s)
cyanophycin macromolecule (CHEBI:65318) is tautomer of (β-Asp-Arg)n zwitterion (CHEBI:137986)
Synonym  Source
(β-L-Asp-L-Arg)n zwitterionChEBI
UniProt Name  Source
[L-4-(L-arginin-2-N-yl)aspartate]nUniProt