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CHEBI:219732 - Corallopyronin A

ChEBI IDCHEBI:219732
ChEBI NameCorallopyronin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H41NO7
Net Charge0
Average Mass527.658
Monoisotopic Mass527.28830
SMILESC/C=C/C/C=C(/C)C(O)CC/C(C)=C/C=C(\C)C(=O)c1c(O)cc(C(C)CC/C=C/NC(=O)OC)oc1=O
InChIInChI=1S/C30H41NO7/c1-7-8-9-12-21(3)24(32)17-15-20(2)14-16-23(5)28(34)27-25(33)19-26(38-29(27)35)22(4)13-10-11-18-31-30(36)37-6/h7-8,11-12,14,16,18-19,22,24,32-33H,9-10,13,15,17H2,1-6H3,(H,31,36)/b8-7+,18-11+,20-14+,21-12-,23-16+
InChIKeyFPBHSTHTCPCNBS-XGPZOFPVSA-N
Species of MetaboliteComponentSourceComments
Corallococcus (ncbitaxon:83461) - PubMed (2581926)
ChEBI Ontology
Outgoing Relation(s)
Corallopyronin A (CHEBI:219732) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
methyl N-[(E)-5-[4-hydroxy-5-[(2E,4E,9Z,12E)-8-hydroxy-2,5,9-trimethyltetradeca-2,4,9,12-tetraenoyl]-6-oxopyran-2-yl]hex-1-enyl]carbamate