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CHEBI:212125 - Heronapyrrole A

ChEBI IDCHEBI:212125
ChEBI NameHeronapyrrole A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H34N2O6
Net Charge0
Average Mass398.500
Monoisotopic Mass398.24169
SMILESCOC(C)(C)[C@H](O)CC/C(C)=C/CCC(C)(O)[C@@H](O)Cc1cnc([N+](=O)[O-])c1
InChIInChI=1S/C20H34N2O6/c1-14(8-9-16(23)19(2,3)28-5)7-6-10-20(4,25)17(24)11-15-12-18(21-13-15)22(26)27/h7,12-13,16-17,21,23-25H,6,8-11H2,1-5H3/b14-7+/t16-,17+,20?/m1/s1
InChIKeyKJBJDUVOMHYMJT-CGGZUEEASA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (20949971)
ChEBI Ontology
Outgoing Relation(s)
Heronapyrrole A (CHEBI:212125) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(E,2S,10R)-11-methoxy-3,7,11-trimethyl-1-(5-nitro-1H-pyrrol-3-yl)dodec-6-ene-2,3,10-triol
Manual XrefsDatabases
27025421ChemSpider