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CHEBI:67675 - Adenolin C

ChEBI IDCHEBI:67675
ChEBI NameAdenolin C
Stars
DefinitionA natural product found in Isodon adenolomus.
Last Modified22 September 2014
DownloadsMolfile
FormulaC23H34O8
Net Charge0
Average Mass438.517
Monoisotopic Mass438.22537
SMILES[H][C@]12C[C@@H](O)[C@@]3([H])[C@]45CCC[C@@](C)(COC(C)=O)[C@@]4([H])[C@H](O)[C@@](O)(OC5)[C@]3(C1)C(=O)[C@@H]2COC
InChIInChI=1S/C23H34O8/c1-12(24)30-10-20(2)5-4-6-21-11-31-23(28,19(27)17(20)21)22-8-13(7-15(25)16(21)22)14(9-29-3)18(22)26/h13-17,19,25,27-28H,4-11H2,1-3H3/t13-,14+,15+,16-,17+,19-,20-,21+,22-,23+/m0/s1
InChIKeyGBMIWIKPOUJCQG-CRDFGLHPSA-N
Species of MetaboliteComponentSourceComments
Isodon adenolomus (ncbitaxon:662903) aerial part (BTO:0001658) PubMed (21534539) 70% aqueous acetone extract of air-dried and powdered aerial parts
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)
Adenolin C (CHEBI:67675) has role metabolite (CHEBI:25212)
Adenolin C (CHEBI:67675) is a kaurane diterpenoid (CHEBI:53666)
Citations