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CHEBI:67663 - Isoadenolin L

ChEBI IDCHEBI:67663
ChEBI NameIsoadenolin L
Stars
DefinitionA natural product found in Isodon adenolomus.
Last Modified22 September 2014
DownloadsMolfile
FormulaC22H30O8
Net Charge0
Average Mass422.474
Monoisotopic Mass422.19407
SMILES[H][C@@]12CC[C@]3([H])C(=C)[C@@H](O)[C@@]1([C@@H]3O)[C@@]1(O)OC(=O)[C@]23[C@@H](OC(C)=O)CCC(C)(C)[C@@]3([H])[C@@H]1O
InChIInChI=1S/C22H30O8/c1-9-11-5-6-12-20-13(29-10(2)23)7-8-19(3,4)14(20)17(26)22(28,30-18(20)27)21(12,15(9)24)16(11)25/h11-17,24-26,28H,1,5-8H2,2-4H3/t11-,12+,13+,14-,15-,16-,17+,20+,21+,22+/m1/s1
InChIKeyRIGOPXZOWRKRQX-XYKAAUHVSA-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 L (CHEBI:67663) has role metabolite (CHEBI:25212)
Isoadenolin L (CHEBI:67663) is a diterpene lactone (CHEBI:49193)
Synonym  Source
1alpha-acetoxy-6beta,7beta,14beta,15beta-tetrahydroxyent-kaur-16-en-7alpha,20-olideChEBI
Citations