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CHEBI:203774 - Prugosene C1

ChEBI IDCHEBI:203774
ChEBI NamePrugosene C1
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H36O3
Net Charge0
Average Mass408.582
Monoisotopic Mass408.26645
SMILESCC1=C[C@@](C)(/C=C/C=C/C=C/C=C/C=C(\C)[C@@H]2O[C@H](C)[C@](C)(O)C=C2C)[C@@H](C)C1=O
InChIInChI=1S/C27H36O3/c1-19(25-21(3)18-27(7,29)23(5)30-25)15-13-11-9-8-10-12-14-16-26(6)17-20(2)24(28)22(26)4/h8-18,22-23,25,29H,1-7H3/b9-8+,12-10+,13-11+,16-14+,19-15+/t22-,23+,25-,26+,27+/m0/s1
InChIKeyAWKOIWWVZPOTLM-UQSVYCHCSA-N
Species of MetaboliteComponentSourceComments
Talaromyces rugulosus (ncbitaxon:121627) - DOI (10.1016/j.tet.2007.09.025)
ChEBI Ontology
Outgoing Relation(s)
Prugosene C1 (CHEBI:203774) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
(4R,5R)-4-[(1E,3E,5E,7E,9E)-10-[(2S,5R,6R)-5-hydroxy-3,5,6-trimethyl-2,6-dihydropyran-2-yl]undeca-1,3,5,7,9-pentaenyl]-2,4,5-trimethylcyclopent-2-en-1-one
Manual XrefsDatabases
23076719ChemSpider