CHEBI:69946 - (1R,3E,7E,11S,12S,14S)-14-Acetoxy-3,7,18-dolabellatriene

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ChEBI Name (1R,3E,7E,11S,12S,14S)-14-Acetoxy-3,7,18-dolabellatriene
ChEBI ID CHEBI:69946
Definition A natural product found in Dilophus spiralis.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H34O2
Net Charge 0
Average Mass 330.50420
Monoisotopic Mass 330.25588
InChI InChI=1S/C22H34O2/c1-15(2)19-14-21(24-18(5)23)22(6)13-12-17(4)9-7-8-16(3)10-11-20(19)22/h8,12,19-21H,1,7,9-11,13-14H2,2-6H3/b16-8+,17-12+/t19-,20+,21+,22-/m1/s1
InChIKey AJUISUYGDAPGKA-KMXMIPMLSA-N
SMILES [H][C@@]12CCC(C)=CCC\C(C)=C\C[C@@]1(C)[C@H](C[C@@H]2C(C)=C)OC(C)=O
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 (1R,3E,7E,11S,12S,14S)-14-Acetoxy-3,7,18-dolabellatriene (CHEBI:69946) has role metabolite (CHEBI:25212)
(1R,3E,7E,11S,12S,14S)-14-Acetoxy-3,7,18-dolabellatriene (CHEBI:69946) is a diterpenoid (CHEBI:23849)
Citation Waiting for Citations Type Source
21190330 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:carboxylic ester(CHEBI:33308); ISA:monocarboxylic acid(CHEBI:25384); ISA:ether(CHEBI:25698); ISA:organonitrogen compound(CHEBI:35352); ISA:carbonyl compound(CHEBI:36586);