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CHEBI:68888 - benarthin

ChEBI IDCHEBI:68888
ChEBI Namebenarthin
Stars
DefinitionA natural product found in Streptomyces species YM5-799 and Streptomyces xanthophaeus.
Last Modified22 September 2014
DownloadsMolfile
FormulaC17H25N5O7
Net Charge0
Average Mass411.415
Monoisotopic Mass411.17540
SMILESC[C@@H](O)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)c1cccc(O)c1O)C(=O)O
InChIInChI=1S/C17H25N5O7/c1-8(23)12(16(28)29)22-15(27)10(5-3-7-20-17(18)19)21-14(26)9-4-2-6-11(24)13(9)25/h2,4,6,8,10,12,23-25H,3,5,7H2,1H3,(H,21,26)(H,22,27)(H,28,29)(H4,18,19,20)/t8-,10+,12+/m1/s1
InChIKeyRYFDAFYFFUVLNW-QRTLGDNMSA-N
Species of MetaboliteComponentSourceComments
Streptomyces species YM5-799 (ncbitaxon:693414) - PubMed (22014204) Streptomyces sp. YM5-799 strain was isolated from a brown alga[Analipus japonicus (Harvey) Wynne]
Streptomyces xanthophaeus (ncbitaxon:67385) - PubMed (22014204) Strain: MJ244 SF1
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)
benarthin (CHEBI:68888) has role metabolite (CHEBI:25212)
benarthin (CHEBI:68888) is a peptide (CHEBI:16670)
Synonyms  Source
L-N-(2,3-dihydroxybenzoyl)arginyl-L-threonineChEBI
(2S,3R)-2-[[(2S)-5-(diaminomethylideneamino)-2-[(2,3-dihydroxybenzoyl)amino]pentanoyl]amino]-3-hydroxybutanoic acidChEBI
N5-(Diaminomethylene)-N2-(2,3-dihydroxybenzoyl)-L-ornithyl-L-threonineChEBI
Manual XrefsDatabases
0143651450ChemIDplus
Citations