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CHEBI:224079 - Rhodocorane I

ChEBI IDCHEBI:224079
ChEBI NameRhodocorane I
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H20O3
Net Charge0
Average Mass236.311
Monoisotopic Mass236.14124
SMILESCC1=C/C(=C2/[C@H](C)CC[C@@H]2[C@H](C)CO)OC1=O
InChIInChI=1S/C14H20O3/c1-8-4-5-11(10(3)7-15)13(8)12-6-9(2)14(16)17-12/h6,8,10-11,15H,4-5,7H2,1-3H3/b13-12+/t8-,10-,11-/m1/s1
InChIKeyCSVYJQZYIZFTCP-JYLGEYMFSA-N
Species of MetaboliteComponentSourceComments
Rhodotus palmatus (ncbitaxon:71920) - PubMed (31820970)
ChEBI Ontology
Outgoing Relation(s)
Rhodocorane I (CHEBI:224079) is a butenolide (CHEBI:50523)
IUPAC Name 
(5E)-5-[(2R,5R)-2-[(2S)-1-hydroxypropan-2-yl]-5-methylcyclopentylidene]-3-methyluran-2-one