CHEBI:203485 - Irlactin B

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Irlactin B
ChEBI ID CHEBI:203485
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H24O4
Net Charge 0
Average Mass 268.353
Monoisotopic Mass 268.16746
InChI InChI=1S/C15H24O4/c1-14(2)5-10-9(7-16)8-4-12(19-13(8)18)15(10,3)11(17)6-14/h8,11-13,16-18H,4-7H2,1-3H3/t8-,11+,12+,13-,15?/m1/s1
InChIKey QMJUHILWLVWMBP-OYOWCSCDSA-N
SMILES O1[C@@H](O)[C@H]2C(CO)=C3C([C@@H]1C2)([C@@H](O)CC(C3)(C)C)C
Metabolite of Species Details
Irpex lacteus (NCBI:txid5319) See: DOI
ChEBI Ontology
Outgoing Irlactin B (CHEBI:203485) is a oxolanes (CHEBI:26912)
IUPAC Name
(1S,3S,9R,10R)-8-(hydroxymethyl)-2,5,5-trimethyl-11-oxatricyclo[7.2.1.02,7]dodec-7-ene-3,10-diol
Manual Xref Database
78440948 ChemSpider
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