CHEBI:227672 - Myrrhlalkyldiol

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 Myrrhlalkyldiol
ChEBI ID CHEBI:227672
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H26O2
Net Charge 0
Average Mass 238.371
Monoisotopic Mass 238.19328
InChI InChI=1S/C15H26O2/c1-11-5-8-13(9-6-11)12(2)7-10-14(16)15(3,4)17/h5,8,12,14,16-17H,6-7,9-10H2,1-4H3
InChIKey JBTWEBDTSZPNTF-UHFFFAOYSA-N
SMILES OC(C(O)CCC(C1=CC=C(C)CC1)C)(C)C
Metabolite of Species Details
Boreostereum vibrans (NCBI:txid1826779) See: PubMed
ChEBI Ontology
Outgoing Myrrhlalkyldiol (CHEBI:227672) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name
2-methyl-6-(4-methylcyclohexa-1,3-dien-1-yl)heptane-2,3-diol
Manual Xref Database
78435735 ChemSpider
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