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CHEBI:70340 - Hirsutalin A

Default Structure
ChEBI IDCHEBI:70340
ChEBI NameHirsutalin A
Stars
DefinitionA natural product found in Cladiella hirsuta.
Last Modified26 August 2015
DownloadsMolfile
FormulaC28H44O7
Net Charge0
Average Mass492.653
Monoisotopic Mass492.30870
SMILES[H][C@]12O[C@]([H])(CC(=C)[C@@H](O)CC[C@@]1(C)OC(=O)[C@H](O)CC)[C@@]1([H])C(C)=CC[C@]([H])([C@@H](C)COC(=O)CCC)[C@@]21[H]
InChIInChI=1S/C28H44O7/c1-7-9-23(31)33-15-18(5)19-11-10-16(3)24-22-14-17(4)21(30)12-13-28(6,26(34-22)25(19)24)35-27(32)20(29)8-2/h10,18-22,24-26,29-30H,4,7-9,11-15H2,1-3,5-6H3/t18-,19+,20+,21-,22+,24+,25+,26+,28+/m0/s1
InChIKeyLGCBXJHPKWYGGG-ZEOQMOKSSA-N
Species of MetaboliteComponentSourceComments
Cladiella hirsuta (WORMS:288617) - PubMed (20979397) Sliced frozen bodies extracted with acetone
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)
Hirsutalin A (CHEBI:70340) has role metabolite (CHEBI:25212)
Hirsutalin A (CHEBI:70340) is a butyrate ester (CHEBI:50477)
Hirsutalin A (CHEBI:70340) is a sesquiterpenoid (CHEBI:26658)
Citations