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CHEBI:203174 - Cyathin C5

ChEBI IDCHEBI:203174
ChEBI NameCyathin C5
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H26O5
Net Charge0
Average Mass346.423
Monoisotopic Mass346.17802
SMILESCC(C(=O)O)C1=C2[C@H]3C[C@H]4OC(O)(C=C4C=O)[C@]3(C)CC[C@@]2(C)CC1
InChIInChI=1S/C20H26O5/c1-11(17(22)23)13-4-5-18(2)6-7-19(3)14(16(13)18)8-15-12(10-21)9-20(19,24)25-15/h9-11,14-15,24H,4-8H2,1-3H3,(H,22,23)/t11?,14-,15-,18-,19-,20?/m1/s1
InChIKeyLRIPDOQBOGYERA-WQPQFCGVSA-N
Species of MetaboliteComponentSourceComments
Cyathus helenae (ncbitaxon:380658) - PubMed (5156938)
ChEBI Ontology
Outgoing Relation(s)
Cyathin C5 (CHEBI:203174) is a diterpenoid (CHEBI:23849)
IUPAC Name 
2-[(2R,5R,10R,12R)-13-ormyl-1-hydroxy-2,5-dimethyl-15-oxatetracyclo[10.2.1.02,10.05,9]pentadeca-8,13-dien-8-yl]propanoic acid
Manual XrefsDatabases
78436970ChemSpider