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CHEBI:66527 - strongylophorine-26

Default Structure
ChEBI IDCHEBI:66527
ChEBI Namestrongylophorine-26
Stars
DefinitionA diterpenoid that is 15,17-epoxypodocarpan-15-one substituted by a hydroxy group at position 13, methyl groups at positions 8 and 13 and a (5-methoxy-3,6-dioxocyclohexa-1,4-dien-1-yl)methyl group at position 14 (the 13α,14β stereoisomer). Isolated from the marine sponge Petrosia corticata, it exhibits antineoplastic activity.
Last Modified6 June 2016
DownloadsMolfile
FormulaC27H36O6
Net Charge0
Average Mass456.579
Monoisotopic Mass456.25119
SMILES[H][C@]12CC[C@](C)(O)[C@@H](CC3=CC(=O)C=C(OC)C3=O)[C@]1(C)CC[C@]1([H])[C@]23CCC[C@]1(C)C(=O)OC3
InChIInChI=1S/C27H36O6/c1-24-10-6-20-25(2)8-5-9-27(20,15-33-23(25)30)19(24)7-11-26(3,31)21(24)13-16-12-17(28)14-18(32-4)22(16)29/h12,14,19-21,31H,5-11,13,15H2,1-4H3/t19-,20-,21-,24+,25-,26-,27-/m0/s1
InChIKeyAMOGVPDDGBDGJG-FOMYWIRZSA-N
Species of MetaboliteComponentSourceComments
Petrosia corticata (WORMS:166869) - PubMed (17407351) Lipophilic extract of the marine sponge Petrosia (Strongylophora) corticata
Roles Classification
Biological Roles:
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.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
strongylophorine-26 (CHEBI:66527) has role animal metabolite (CHEBI:75767)
strongylophorine-26 (CHEBI:66527) has role antineoplastic agent (CHEBI:35610)
strongylophorine-26 (CHEBI:66527) has role marine metabolite (CHEBI:76507)
strongylophorine-26 (CHEBI:66527) is a p-quinones (CHEBI:25830)
strongylophorine-26 (CHEBI:66527) is a diterpenoid (CHEBI:23849)
strongylophorine-26 (CHEBI:66527) is a enol ether (CHEBI:47985)
strongylophorine-26 (CHEBI:66527) is a meroterpenoid (CHEBI:64419)
strongylophorine-26 (CHEBI:66527) is a tertiary alcohol (CHEBI:26878)
strongylophorine-26 (CHEBI:66527) is a γ-lactone (CHEBI:37581)
IUPAC Name 
2-{[(13α,14β)-13-hydroxy-8,13-dimethyl-15-oxo-15,17-epoxypodocarpan-14-yl]methyl}-6-methoxycyclohexa-2,5-diene-1,4-dione
Registry NumbersSources
Reaxys:10738211Reaxys
Citations