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CHEBI:67806 - Joro spider toxin-4

ChEBI IDCHEBI:67806
ChEBI NameJoro spider toxin-4
Stars
DefinitionA natural product found in Nephila clavata.
Last Modified22 September 2014
DownloadsMolfile
FormulaC28H48N10O7
Net Charge0
Average Mass636.755
Monoisotopic Mass636.37074
SMILESN=C(N)NCCC[C@H](N)C(=O)N[C@@H](CCCN)C(=O)NCCCCCNC(=O)[C@H](CC(N)=O)NC(=O)Cc1ccc(O)cc1O
InChIInChI=1S/C28H48N10O7/c29-10-4-7-20(38-25(43)19(30)6-5-13-36-28(32)33)26(44)34-11-2-1-3-12-35-27(45)21(16-23(31)41)37-24(42)14-17-8-9-18(39)15-22(17)40/h8-9,15,19-21,39-40H,1-7,10-14,16,29-30H2,(H2,31,41)(H,34,44)(H,35,45)(H,37,42)(H,38,43)(H4,32,33,36)/t19-,20-,21-/m0/s1
InChIKeyCRZSEQMZZYKNLU-ACRUOGEOSA-N
Species of MetaboliteComponentSourceComments
Nephila clavata (ncbitaxon:70342) - PubMed (21188966)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Joro spider toxin-4 (CHEBI:67806) has role metabolite (CHEBI:25212)
Joro spider toxin-4 (CHEBI:67806) is a peptide (CHEBI:16670)
Synonyms  Source
(S)-N1-(5-((S)-5-Amino-2-((S)-2-amino-5-guanidinopentanamido)pentanamido)pentyl)-2-(2-(2,4-dihydroxyphenyl)acetamido)succinamideChEBI
JSTX-4ChEBI
Citations