CHEBI:198913 - Sch 725434

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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 Sch 725434
ChEBI ID CHEBI:198913
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H22O3
Net Charge 0
Average Mass 250.338
Monoisotopic Mass 250.15689
InChI InChI=1S/C15H22O3/c1-9-4-5-12-10(7-14(12,2)3)11-8-18-15(17,6-9)13(11)16/h10-12,17H,1,4-8H2,2-3H3/t10-,11+,12-,15-/m0/s1
InChIKey RUGRQWJJZMMLJI-OXIQGZBJSA-N
SMILES O=C1[C@]2(OC[C@@H]1[C@H]3[C@@H](C(C)(C)C3)CCC(C2)=C)O
Metabolite of Species Details
Arachnomyces pilosus (NCBI:txid2219008) See: PubMed
ChEBI Ontology
Outgoing Sch 725434 (CHEBI:198913) is a oxolanes (CHEBI:26912)
IUPAC Name
(1S,2R,5S,10S)-10-hydroxy-4,4-dimethyl-8-methylidene-11-oxatricyclo[8.2.1.02,5]tridecan-13-one
Manual Xref Database
24624295 ChemSpider
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