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CHEBI:224789 - Pannomycin

ChEBI IDCHEBI:224789
ChEBI NamePannomycin
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SubmitterMetaboLights
DownloadsMolfile
FormulaC22H32O3
Net Charge0
Average Mass344.495
Monoisotopic Mass344.23514
SMILESC/C=C/[C@H]1C(C)=C[C@H]2C[C@H](C)[C@H](O)C[C@H]2[C@]1(C)/C=C(C)/C=C/C(=O)O
InChIInChI=1S/C22H32O3/c1-6-7-18-15(3)10-17-11-16(4)20(23)12-19(17)22(18,5)13-14(2)8-9-21(24)25/h6-10,13,16-20,23H,11-12H2,1-5H3,(H,24,25)/b7-6+,9-8+,14-13+/t16-,17-,18-,19+,20+,22+/m0/s1
InChIKeyFFRJHWIQULDGGE-CUYCTCHZSA-N
Species of MetaboliteComponentSourceComments
Pseudogymnoascus pannorum (ncbitaxon:79858) - PubMed (19102658)
ChEBI Ontology
Outgoing Relation(s)
Pannomycin (CHEBI:224789) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
(2E,4E)-5-[(1R,2S,4aR,6S,7R,8aR)-7-hydroxy-1,3,6-trimethyl-2-[(E)-prop-1-enyl]-4a,5,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]-4-methylpenta-2,4-dienoic acid
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24625500ChemSpider