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CHEBI:202864 - Syringolin G

Default Structure
ChEBI IDCHEBI:202864
ChEBI NameSyringolin G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H45N5O6
Net Charge0
Average Mass523.675
Monoisotopic Mass523.33698
SMILESCC[C@H](C)[C@H](NC(=O)N[C@H](C(=O)N[C@H]1CCCCNC(=O)/C=C\[C@H](C(C)C)NC1=O)[C@@H](C)CC)C(=O)O
InChIInChI=1S/C26H45N5O6/c1-7-16(5)21(30-26(37)31-22(25(35)36)17(6)8-2)24(34)29-19-11-9-10-14-27-20(32)13-12-18(15(3)4)28-23(19)33/h12-13,15-19,21-22H,7-11,14H2,1-6H3,(H,27,32)(H,28,33)(H,29,34)(H,35,36)(H2,30,31,37)/b13-12-/t16-,17-,18+,19-,21-,22-/m0/s1
InChIKeyPTRNCNFJAWMJBV-HGDWBSSWSA-N
Species of MetaboliteComponentSourceComments
Pseudomonas syringae (ncbitaxon:317) - PubMed (22851214)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Syringolin G (CHEBI:202864) is a cyclic peptide (CHEBI:23449)
IUPAC Name 
(2S,3S)-2-[[(2S,3S)-1-[[(3Z,5S,8S)-2,7-dioxo-5-propan-2-yl-1,6-diazacyclododec-3-en-8-yl]amino]-3-methyl-1-oxopentan-2-yl]carbamoylamino]-3-methylpentanoic acid
Manual XrefsDatabases
78442555ChemSpider