CHEBI:203789 - Boletinin A

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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 Boletinin A
ChEBI ID CHEBI:203789
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H34O3
Net Charge 0
Average Mass 322.489
Monoisotopic Mass 322.25079
InChI InChI=1S/C20H34O3/c1-17(8-5-9-18(2)12-15-21)10-6-13-20(4,23)14-7-11-19(3)16-22/h6,8,11-13,21-23H,5,7,9-10,14-16H2,1-4H3/b13-6+,17-8+,18-12+,19-11+/t20-/m1/s1
InChIKey QVPAFHFVRMUTMO-IYDJPMGSSA-N
SMILES O[C@](/C=C/C/C(=C/CC/C(=C/CO)/C)/C)(CC/C=C(/CO)\C)C
Metabolite of Species Details
Boletinus cavipes (NCBI:txid85973) See: PubMed
ChEBI Ontology
Outgoing Boletinin A (CHEBI:203789) is a diterpenoid (CHEBI:23849)
IUPAC Name
(2E,7E,10E,14E)-2,6,10,14-tetramethylhexadeca-2,7,10,14-tetraene-1,6,16-triol
Manual Xref Database
9373140 ChemSpider
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