CHEBI:138048 - stellata-2,6,19-triene

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ChEBI Name stellata-2,6,19-triene
ChEBI ID CHEBI:138048
Definition A tricyclic sesterterpene with formula C25H40 that is obtained from Aspergillus stellatus.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
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Formula C25H40
Net Charge 0
Average Mass 340.595
Monoisotopic Mass 340.31300
InChI InChI=1S/C25H40/c1-18(2)21-13-17-25(6)22(21)14-16-24(5)15-12-20(4)9-7-8-19(3)10-11-23(24)25/h8,12,21-23H,1,7,9-11,13-17H2,2-6H3/b19-8+,20-12+/t21-,22-,23-,24+,25-/m1/s1
InChIKey JFQLHYSXZPELNV-LNYIGJDBSA-N
SMILES [H][C@]12CC[C@]3(C)C\C=C(C)\CC\C=C(C)\CC[C@@]3([H])[C@]1(C)CC[C@@H]2C(C)=C
Metabolite of Species Details
Aspergillus stellatus (NCBI:txid1549217) See: PubMed
Roles Classification
Biological Role(s): fungal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
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ChEBI Ontology
Outgoing stellata-2,6,19-triene (CHEBI:138048) has role fungal metabolite (CHEBI:76946)
stellata-2,6,19-triene (CHEBI:138048) is a carbotricyclic compound (CHEBI:38032)
stellata-2,6,19-triene (CHEBI:138048) is a polycyclic olefin (CHEBI:35714)
stellata-2,6,19-triene (CHEBI:138048) is a sesterterpene (CHEBI:35192)
IUPAC Name
(3S,3aR,5aR,7E,11E,14aR,14bR)-5a,8,12,14b-tetramethyl-3-(prop-1-en-2-yl)-1,2,3,3a,4,5,5a,6,9,10,13,14,14a,14b-tetradecahydrocycloundeca[e]indene
Synonym Source
stellata-2,6,19-triene UniProt
Manual Xref Database
CPD-18553 MetaCyc
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Registry Number Type Source
28601869 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
26351860 PubMed citation SUBMITTER
28673978 PubMed citation Europe PMC
Last Modified
03 August 2020