CHEBI:207529 - Penicillar 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 Penicillar B
ChEBI ID CHEBI:207529
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C11H18O2
Net Charge 0
Average Mass 182.263
Monoisotopic Mass 182.13068
InChI InChI=1S/C11H18O2/c1-3-4-10(8-12)7-11-6-5-9(2)13-11/h3-4,7,9,11-12H,5-6,8H2,1-2H3/b4-3+,10-7-/t9-,11+/m1/s1
InChIKey KGMSVLHLHNQUSI-KEDYSELCSA-N
SMILES O1[C@H](/C=C(/C=C/C)\CO)CC[C@H]1C
Metabolite of Species Details
Penicilliumspecies SCS-KFD08 (NCBI:txid1808020) See: PubMed
ChEBI Ontology
Outgoing Penicillar B (CHEBI:207529) is a oxolanes (CHEBI:26912)
IUPAC Name
(E,2Z)-2-[[(2S,5R)-5-methyloxolan-2-yl]methylidene]pent-3-en-1-ol
Manual Xref Database
60596935 ChemSpider
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