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CHEBI:67658 - Isoadenolin G, (rel)-

ChEBI IDCHEBI:67658
ChEBI NameIsoadenolin G, (rel)-
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@@]12[C@@H](OC(C)=O)C[C@]3([H])C(=C)[C@@H](O)[C@@]1([C@@H]3O)[C@@]1(O)O[C@H](OC)[C@]23CCCC(C)(C)[C@@]3([H])[C@@H]1O
InChIInChI=1S/C23H34O8/c1-10-12-9-13(30-11(2)24)14-21-8-6-7-20(3,4)15(21)18(27)23(28,31-19(21)29-5)22(14,16(10)25)17(12)26/h12-19,25-28H,1,6-9H2,2-5H3/t12-,13+,14+,15-,16-,17-,18+,19+,21-,22+,23+/m1/s1
InChIKeyZXTOBFVGAFEONZ-MJBJSSGESA-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)
Isoadenolin G, (rel)- (CHEBI:67658) has role metabolite (CHEBI:25212)
Isoadenolin G, (rel)- (CHEBI:67658) is a kaurane diterpenoid (CHEBI:53666)
Citations