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CHEBI:226484 - Plantaribactin

ChEBI IDCHEBI:226484
ChEBI NamePlantaribactin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC44H76N14O19
Net Charge0
Average Mass1105.171
Monoisotopic Mass1104.54112
SMILESCCCCCCCCCCCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](CO)C(=O)N[C@H]1CCCNC(=O)[C@@H](CCCN(O)N=O)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCN(O)N=O)NC1=O)[C@@H](O)C(=O)O
InChIInChI=1S/C44H76N14O19/c1-2-3-4-5-6-7-8-9-10-17-33(62)54-35(36(64)44(72)73)43(71)53-31(25-60)42(70)52-30(24-59)41(69)50-27-14-11-20-46-37(65)26(15-12-21-57(76)55-74)48-34(63)23-47-38(66)29(18-19-32(45)61)51-40(68)28(49-39(27)67)16-13-22-58(77)56-75/h26-31,35-36,59-60,64,76-77H,2-25H2,1H3,(H2,45,61)(H,46,65)(H,47,66)(H,48,63)(H,49,67)(H,50,69)(H,51,68)(H,52,70)(H,53,71)(H,54,62)(H,72,73)/t26-,27+,28-,29+,30-,31+,35+,36-/m1/s1
InChIKeyLZKYOIUQAOXDOE-KXPMJRMKSA-N
Species of MetaboliteComponentSourceComments
Burkholderia plantarii (ncbitaxon:41899) - PubMed (31276269)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Plantaribactin (CHEBI:226484) is a cyclic peptide (CHEBI:23449)