CHEBI:225127 - Boletinin H

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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 H
ChEBI ID CHEBI:225127
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C24H34O6
Net Charge 0
Average Mass 418.530
Monoisotopic Mass 418.23554
InChI InChI=1S/C24H34O6/c1-18(8-5-9-19(2)12-7-13-21(4)24(28)29)10-6-11-20(3)16-17-30-23(27)15-14-22(25)26/h9-10,13-16H,5-8,11-12,17H2,1-4H3,(H,25,26)(H,28,29)/b15-14+,18-10+,19-9+,20-16+,21-13+
InChIKey ZGKBVLVSZSECNY-PAUNICHOSA-N
SMILES O=C(O)/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/COC(=O)/C=C/C(=O)O)/C)/C)/C)/C
Metabolite of Species Details
Boletinus cavipes (NCBI:txid85973) See: PubMed
ChEBI Ontology
Outgoing Boletinin H (CHEBI:225127) is a diterpenoid (CHEBI:23849)
IUPAC Name
(2E,6E,10E,14E)-16-[(E)-3-carboxyprop-2-enoyl]oxy-2,6,10,14-tetramethylhexadeca-2,6,10,14-tetraenoic acid
Manual Xref Database
9650438 ChemSpider
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