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CHEBI:209523 - Phomophyllin B

ChEBI IDCHEBI:209523
ChEBI NamePhomophyllin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O3
Net Charge0
Average Mass248.322
Monoisotopic Mass248.14124
SMILESCC1=C2CC[C@]2(C)[C@]2(O)C(=CC(C)(C)[C@H]2O)C1=O
InChIInChI=1S/C15H20O3/c1-8-9-5-6-14(9,4)15(18)10(11(8)16)7-13(2,3)12(15)17/h7,12,17-18H,5-6H2,1-4H3/t12-,14+,15+/m1/s1
InChIKeyQUANYNAZEOWVLR-SNPRPXQTSA-N
Species of MetaboliteComponentSourceComments
Phomopsis (ncbitaxon:34399) - PubMed (29771527)
ChEBI Ontology
Outgoing Relation(s)
Phomophyllin B (CHEBI:209523) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(7R,7aS,7bS)-7,7a-dihydroxy-3,6,6,7b-tetramethyl-2,7-dihydro-1H-cyclobuta[e]inden-4-one
Manual XrefsDatabases
78439075ChemSpider