CHEBI:228071 - Irpexlacte A

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ChEBI Name Irpexlacte A
ChEBI ID CHEBI:228071
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H22O4
Net Charge 0
Average Mass 266.337
Monoisotopic Mass 266.15181
InChI InChI=1S/C15H22O4/c1-7-9-5-15(2,3)6-10(9)12(13(16)17)8-4-11(7)19-14(8)18/h7-9,11,14,18H,4-6H2,1-3H3,(H,16,17)/t7-,8+,9+,11+,14-/m0/s1
InChIKey HAJPBKJDHYPJHO-RDICWGLJSA-N
SMILES O=C(O)C1=C2[C@@H]([C@H](C)[C@H]3C[C@H]1[C@H](O3)O)CC(C2)(C)C
Metabolite of Species Details
Irpex (NCBI:txid5318) See: DOI
ChEBI Ontology
Outgoing Irpexlacte A (CHEBI:228071) is a oxolanes (CHEBI:26912)
IUPAC Name
(1R,7R,8S,9R,11S)-11-hydroxy-5,5,8-trimethyl-10-oxatricyclo[7.2.1.03,7]dodec-2-ene-2-carboxylic acid