CHEBI:67758 - (−)-duryne E

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ChEBI Name (−)-duryne E
ChEBI ID CHEBI:67758
ChEBI ASCII Name (-)-duryne E
Definition An enyne that is (4E,15Z,21Z,32E)-hexatriaconta-4,15,21,32-tetraene-1,35-diyne substituted by hydroxy groups at positions 3 and 34 (the 3R,34R-stereoisomer). It has been isolated from the marine sponge Petrosia.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C36H58O2
Net Charge 0
Average Mass 522.84450
Monoisotopic Mass 522.44368
InChI InChI=1S/C36H58O2/c1-3-35(37)33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36(38)4-2/h1-2,9-12,31-38H,5-8,13-30H2/b11-9-,12-10-,33-31+,34-32+/t35-,36-/m0/s1
InChIKey XAIZWFVGVMCODQ-IJQLRHIVSA-N
SMILES O[C@H](\C=C\CCCCCCCCC\C=C/CCCC\C=C/CCCCCCCCC\C=C\[C@@H](O)C#C)C#C
Metabolite of Species Details
Petrosia (NCBI:txid68563) Frozen sponge was homogenized and extracted with EtOH and MeOH/CHCl3 (1:1) See: PubMed
Roles Classification
Biological Role(s): animal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in animals that include diverse creatures from sponges, insects to mammals.
marine metabolite
Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (−)-duryne E (CHEBI:67758) has role animal metabolite (CHEBI:75767)
(−)-duryne E (CHEBI:67758) has role antineoplastic agent (CHEBI:35610)
(−)-duryne E (CHEBI:67758) has role marine metabolite (CHEBI:76507)
(−)-duryne E (CHEBI:67758) is a diol (CHEBI:23824)
(−)-duryne E (CHEBI:67758) is a enyne (CHEBI:59831)
(−)-duryne E (CHEBI:67758) is a secondary alcohol (CHEBI:35681)
(−)-duryne E (CHEBI:67758) is a terminal acetylenic compound (CHEBI:73477)
IUPAC Name
(3R,4E,15Z,21Z,32E,34R)-hexatriaconta-4,15,21,32-tetraene-1,35-diyne-3,34-diol
Registry Number Type Source
21556542 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21534590 PubMed citation Europe PMC
Last Modified
13 April 2015