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CHEBI:221097 - Anti-12-hydroxypretenellin A

ChEBI IDCHEBI:221097
ChEBI NameAnti-12-hydroxypretenellin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H25NO5
Net Charge0
Average Mass371.433
Monoisotopic Mass371.17327
SMILESCC(/C=C/C(O)=C1C(=O)N[C@@H](Cc2ccc(O)cc2)C1=O)=C\[C@H](C)[C@@H](C)O
InChIInChI=1S/C21H25NO5/c1-12(10-13(2)14(3)23)4-9-18(25)19-20(26)17(22-21(19)27)11-15-5-7-16(24)8-6-15/h4-10,13-14,17,23-25H,11H2,1-3H3,(H,22,27)/b9-4+,12-10+,19-18?/t13-,14+,17-/m0/s1
InChIKeyPJJOESIMAAZBQS-HOZBOIJISA-N
Species of MetaboliteComponentSourceComments
Beauveria (ncbitaxon:5581) - PubMed (21675761)
ChEBI Ontology
Outgoing Relation(s)
Anti-12-hydroxypretenellin A (CHEBI:221097) is a phenols (CHEBI:33853)
IUPAC Name 
(5S)-3-[(2E,4E,6S,7R)-1,7-dihydroxy-4,6-dimethylocta-2,4-dienylidene]-5-[(4-hydroxyphenyl)methyl]pyrrolidine-2,4-dione
Manual XrefsDatabases
78440411ChemSpider