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CHEBI:216835 - Plantaricin GZ1-27

ChEBI IDCHEBI:216835
ChEBI NamePlantaricin GZ1-27
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC42H65N13O14
Net Charge0
Average Mass976.059
Monoisotopic Mass975.47739
SMILESCC(C)[C@H](N)C(=O)N[C@@H](CO)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](Cc1cncn1)C(=O)O)[C@@H](C)O
InChIInChI=1S/C42H65N13O14/c1-21(2)33(43)39(65)51-26(19-56)36(62)47-18-31(59)53-11-5-9-28(53)38(64)49-22(3)35(61)46-17-32(60)54-12-7-10-29(54)41(67)55-13-6-8-27(55)37(63)45-16-30(58)52-34(23(4)57)40(66)50-25(42(68)69)14-24-15-44-20-48-24/h15,20-23,25-29,33-34,56-57H,5-14,16-19,43H2,1-4H3,(H,44,48)(H,45,63)(H,46,61)(H,47,62)(H,49,64)(H,50,66)(H,51,65)(H,52,58)(H,68,69)/t22-,23+,25-,26-,27-,28-,29-,33-,34-/m0/s1
InChIKeyJXGOUEQUGLLMQA-XXKMKNTMSA-N
Species of MetaboliteComponentSourceComments
Lactobacillus (ncbitaxon:1578) - PubMed (29690762)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Plantaricin GZ1-27 (CHEBI:216835) is a peptide (CHEBI:16670)
IUPAC Name 
(2S)-2-[[(2S,3R)-2-[[2-[[(2S)-1-[(2S)-1-[2-[[(2S)-2-[[(2S)-1-[2-[[(2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-3-hydroxypropanoyl]amino]acetyl]pyrrolidine-2-carbonyl]amino]propanoyl]amino]acetyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]acetyl]amino]-3-hydroxybutanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid