CHEBI:138228 - β-heptaprene

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ChEBI Name β-heptaprene
ChEBI ID CHEBI:138228
ChEBI ASCII Name beta-heptaprene
Definition An acyclic sesquarterpene that is 3-methylideneoctacosa-1,6,10,14,18,22,26-heptaene carrying six methyl substituents at positions 7, 11, 15, 19, 23 and 27 (the all-E geoisomer).
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
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Formula C35H56
Net Charge 0
Average Mass 476.820
Monoisotopic Mass 476.43820
InChI InChI=1S/C35H56/c1-10-30(4)18-12-20-32(6)22-14-24-34(8)26-16-28-35(9)27-15-25-33(7)23-13-21-31(5)19-11-17-29(2)3/h10,17,20-21,24-25,28H,1,4,11-16,18-19,22-23,26-27H2,2-3,5-9H3/b31-21+,32-20+,33-25+,34-24+,35-28+
InChIKey YNWDINKHLIWBQT-YDTSVZKTSA-N
SMILES C(/C(=C/CC/C(/C)=C/CC/C(=C/CC/C(=C/CC/C(=C/CCC(C=C)=C)/C)/C)/C)/C)CC=C(C)C
Metabolite of Species Details
Bacillus clausii (NCBI:txid79880) See: PubMed
Roles Classification
Biological Role(s): bacterial metabolite
Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing β-heptaprene (CHEBI:138228) has functional parent trans-β-farnesene (CHEBI:10418)
β-heptaprene (CHEBI:138228) has role bacterial metabolite (CHEBI:76969)
β-heptaprene (CHEBI:138228) is a polyene (CHEBI:48121)
β-heptaprene (CHEBI:138228) is a sesquarterpene (CHEBI:64804)
IUPAC Name
(6E,10E,14E,18E,22E)-7,11,15,19,23,27-hexamethyl-3-methylideneoctacosa-1,6,10,14,18,22,26-heptaene
Synonym Source
beta-heptaprene UniProt
Manual Xref Database
CPD-20443 MetaCyc
View more database links
Registry Number Type Source
28283698 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
23554321 PubMed citation SUBMITTER
25882275 PubMed citation SUBMITTER
Last Modified
30 October 2017