CHEBI:67755 - (−)-duryne B

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (−)-duryne B
ChEBI ID CHEBI:67755
ChEBI ASCII Name (-)-duryne B
Definition An enyne that is (4E,15Z,28E)-dotriaconta-4,15,28-triene-1,31-diyne substituted by hydroxy groups at positions 3 and 30 (the 3R,30R-stereoiosmer). It has been isolated from the marine sponge Petrosia.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C32H52O2
Net Charge 0
Average Mass 468.75410
Monoisotopic Mass 468.39673
InChI InChI=1S/C32H52O2/c1-3-31(33)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)4-2/h1-2,5,7,27-34H,6,8-26H2/b7-5-,29-27+,30-28+/t31-,32-/m0/s1
InChIKey ZEWIWYQCBPUQNR-JIHXWXSTSA-N
SMILES O[C@H](\C=C\CCCCCCCCCCC\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 B (CHEBI:67755) has role animal metabolite (CHEBI:75767)
(−)-duryne B (CHEBI:67755) has role antineoplastic agent (CHEBI:35610)
(−)-duryne B (CHEBI:67755) has role marine metabolite (CHEBI:76507)
(−)-duryne B (CHEBI:67755) is a diol (CHEBI:23824)
(−)-duryne B (CHEBI:67755) is a enyne (CHEBI:59831)
(−)-duryne B (CHEBI:67755) is a secondary alcohol (CHEBI:35681)
(−)-duryne B (CHEBI:67755) is a terminal acetylenic compound (CHEBI:73477)
IUPAC Name
(3R,4E,15Z,28E,30R)-dotriaconta-4,15,28-triene-1,31-diyne-3,30-diol
Registry Number Type Source
21556540 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21534590 PubMed citation Europe PMC
Last Modified
13 April 2015