CHEBI:7883 - PR-toxin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name PR-toxin
ChEBI ID CHEBI:7883
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C17H20O6
Net Charge 0
Average Mass 320.338
Monoisotopic Mass 320.126
InChI InChI=1S/C17H20O6/c1-8-12(21-9(2)19)14-13(22-14)10-5-11(20)17(6-15(8,10)3)16(4,7-18)23-17/h5,7-8,12-14H,6H2,1-4H3/t8-,12+,13-,14+,15+,16+,17-/m0/s1
InChIKey GSPFUBNBRPVALJ-VIEAGMIOSA-N
SMILES C[C@H]1[C@@H](OC(C)=O)[C@H]2O[C@H]2C2=CC(=O)[C@]3(C[C@]12C)O[C@]3(C)C=O
ChEBI Ontology
Outgoing PR-toxin (CHEBI:7883) is a oxacycle (CHEBI:38104)
Synonyms Sources
PR Toxin KEGG COMPOUND
PR-toxin KEGG COMPOUND
Manual Xrefs Databases
C00003176 KNApSAcK
C06079 KEGG COMPOUND
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Registry Number Type Source
56299-00-4 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014