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CHEBI:69859 - Cosmosporaside E, (rel)-

ChEBI IDCHEBI:69859
ChEBI NameCosmosporaside E, (rel)-
Stars
DefinitionA natural product found in Cosmospora joca.
Last Modified22 September 2014
DownloadsMolfile
FormulaC39H68O16
Net Charge0
Average Mass792.957
Monoisotopic Mass792.45074
SMILESCCCCC/C=C\CCC(=O)O[C@@H]1[C@H](O[C@@H](C[C@H](OC(C)=O)/C(C)=C/CO[C@@H]([C@H](O)[C@H](O)CO)[C@H](O)CO)[C@](C)(O)CCC=C(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O
InChIInChI=1S/C39H68O16/c1-7-8-9-10-11-12-13-16-32(46)55-37-35(49)34(48)30(23-42)53-38(37)54-31(39(6,50)18-14-15-24(2)3)20-29(52-26(5)43)25(4)17-19-51-36(28(45)22-41)33(47)27(44)21-40/h11-12,15,17,27-31,33-38,40-42,44-45,47-50H,7-10,13-14,16,18-23H2,1-6H3/b12-11-,25-17+/t27-,28-,29+,30-,31+,33-,34-,35+,36-,37+,38+,39-/m1/s1
InChIKeyBNBIPVQRFYGGRR-HIMNOAGTSA-N
Species of MetaboliteComponentSourceComments
Cosmospora joca (fungorum:460234) - PubMed (21682264) Ethyl acetate extract of fermented broth. Strain: 89041201
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Cosmosporaside E, (rel)- (CHEBI:69859) has role metabolite (CHEBI:25212)
Cosmosporaside E, (rel)- (CHEBI:69859) is a lipopolysaccharide (CHEBI:16412)
Synonym  Source
rel-3-O-[(2E,4S,6S,7R)-4-Acetoxy-6-({2-O-[(4Z)-4-decenoyl]-beta-D-mannopyranosyl}oxy)-7-hydroxy-3,7,11-trimethyl-2,10-dodecadien-1-yl]-D-mannitolChEBI
Citations