CHEBI:69941 - rel-(1R,3E,7E,11S,12R)-14-Oxo-3,7,18-dolabellatriene

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ChEBI Name rel-(1R,3E,7E,11S,12R)-14-Oxo-3,7,18-dolabellatriene
ChEBI ID CHEBI:69941
Definition A natural product found in Dilophus spiralis.
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C20H30O
Net Charge 0
Average Mass 286.45160
Monoisotopic Mass 286.22967
InChI InChI=1S/C20H30O/c1-14(2)17-13-19(21)20(5)12-11-16(4)8-6-7-15(3)9-10-18(17)20/h7,11,17-18H,1,6,8-10,12-13H2,2-5H3/b15-7+,16-11+/t17-,18-,20+/m0/s1
InChIKey RNHJVFUOEQKJEA-OEMINUNOSA-N
SMILES [H][C@@]12CCC(C)=CCC\C(C)=C\C[C@@]1(C)C(=O)C[C@H]2C(C)=C
Metabolite of Species Details
Dilophus sp.ralis (NCBI:txid499621) Dichloromethane extract of freeze-dried alga See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
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ChEBI Ontology
Outgoing rel-(1R,3E,7E,11S,12R)-14-Oxo-3,7,18-dolabellatriene (CHEBI:69941) has role metabolite (CHEBI:25212)
rel-(1R,3E,7E,11S,12R)-14-Oxo-3,7,18-dolabellatriene (CHEBI:69941) is a diterpenoid (CHEBI:23849)
rel-(1R,3E,7E,11S,12R)-14-Oxo-3,7,18-dolabellatriene (CHEBI:69941) is a dolabellane diterpenoid (CHEBI:144945)
Citation Waiting for Citations Type Source
21190330 PubMed citation Europe PMC
Last Modified
24 September 2019
General Comment
2014-10-17 Suggested Classification: ISA:ketone(CHEBI:17087);