CHEBI:66713 - Pacificin C(rel)

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ChEBI Name Pacificin C(rel)
ChEBI ID CHEBI:66713
Definition A natural product found in Nephthea pacifica.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C20H34O4
Net Charge 0
Average Mass 338.48160
Monoisotopic Mass 338.24571
InChI InChI=1S/C20H34O4/c1-17(2,24-22)8-6-9-18(3)11-12-20(5)16(23-20)7-10-19(4,21)15-13-14(15)18/h6,8,14-16,21-22H,7,9-13H2,1-5H3/b8-6+/t14-,15-,16-,18-,19-,20-/m0/s1
InChIKey QVXHUQXNTXETOI-IMMUYQCLSA-N
SMILES [H][C@]12CC[C@](C)(O)[C@@]3([H])C[C@]3([H])[C@](C)(CC[C@]1(C)O2)C\C=C\C(C)(C)OO
Metabolite of Species Details
Nephthea pacifica (WORMS:288680) 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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Pacificin C(rel) (CHEBI:66713) has role metabolite (CHEBI:25212)
Pacificin C(rel) (CHEBI:66713) is a tertiary alcohol (CHEBI:26878)
Synonym Source
rel-(1S,2S,5S,7S,10R,11S)-10-[4-Hydroperoxy-4-methyl-2-penten-1-yl]-2,7,10-trimethyl-6-oxatricyclo[9.1.0.05,7]dodecan-2-ol ChEBI
Citation Waiting for Citations Type Source
15679321 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:peroxol(CHEBI:35924); ISA:epoxide(CHEBI:32955); ISA:ether(CHEBI:25698);