CHEBI:70340 - Hirsutalin A

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ChEBI Name Hirsutalin A
ChEBI ID CHEBI:70340
Definition A natural product found in Cladiella hirsuta.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C28H44O7
Net Charge 0
Average Mass 492.64480
Monoisotopic Mass 492.30870
InChI InChI=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
InChIKey LGCBXJHPKWYGGG-ZEOQMOKSSA-N
SMILES [H][C@]12CC(=C)[C@@H](O)CC[C@@](C)(OC(=O)[C@H](O)CC)[C@]([H])(O1)[C@]1([H])[C@]([H])(CC=C(C)[C@]21[H])[C@@H](C)COC(=O)CCC
Metabolite of Species Details
Cladiella hirsuta (WORMS:288617) Sliced frozen bodies extracted with acetone See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 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)
Citation Waiting for Citations Type Source
20979397 PubMed citation Europe PMC
Last Modified
26 August 2015
General Comment
2014-10-17 Suggested Classification: ISA:fatty acid ester(CHEBI:35748); ISA:dicarboxylic acid(CHEBI:35692); ISA:oxolanes(CHEBI:26912); ISA:secondary alcohol(CHEBI:35681); ISA:carboxylic ester(CHEBI:33308); ISA:ether(CHEBI:25698); ISA:organonitrogen compound(CHEBI:35352); ISA:carbonyl compound(CHEBI:36586);