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CHEBI:216567 - Creolophin A

ChEBI IDCHEBI:216567
ChEBI NameCreolophin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H16O5
Net Charge0
Average Mass264.277
Monoisotopic Mass264.09977
SMILESC=C1[C@@H](O)[C@H]2O[C@]23C[C@H]2[C@H]4O[C@@]4(C)C(=O)[C@@]2(O)[C@]13C
InChIInChI=1S/C14H16O5/c1-5-7(15)9-13(19-9)4-6-8-11(2,18-8)10(16)14(6,17)12(5,13)3/h6-9,15,17H,1,4H2,2-3H3/t6-,7+,8+,9+,11+,12+,13+,14+/m0/s1
InChIKeyMRHBYRWFKBWHSE-FQTMVLHBSA-N
Species of MetaboliteComponentSourceComments
Hericium cirrhatum (ncbitaxon:139397) - DOI (10.1002/ejoc.200700555)
ChEBI Ontology
Outgoing Relation(s)
Creolophin A (CHEBI:216567) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1S,3S,4R,6R,8S,9S,11R,12R)-8,11-dihydroxy-6,9-dimethyl-10-methylidene-5,13-dioxapentacyclo[7.4.0.01,12.03,8.04,6]tridecan-7-one
Manual XrefsDatabases
78438122ChemSpider