CHEBI:216610 - Penicimonoterpene

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 Penicimonoterpene
ChEBI ID CHEBI:216610
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H20O5
Net Charge 0
Average Mass 244.287
Monoisotopic Mass 244.13107
InChI InChI=1S/C12H20O5/c1-9(8-17-10(2)13)5-4-6-12(3,16)7-11(14)15/h5,16H,4,6-8H2,1-3H3,(H,14,15)/b9-5+/t12-/m0/s1
InChIKey JOYLASSUVMVSGN-LHXVZLOVSA-N
SMILES O=C(O)C[C@@](O)(CC/C=C(/COC(=O)C)\C)C
Metabolite of Species Details
Penicillium (NCBI:txid5073) See: PubMed
ChEBI Ontology
Outgoing Penicimonoterpene (CHEBI:216610) is a monoterpenoid (CHEBI:25409)
IUPAC Name
(E)-8-acetyloxy-3-hydroxy-3,7-dimethyloct-6-enoic acid
Manual Xref Database
78436018 ChemSpider
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