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CHEBI:67677 - Longikaurin A

ChEBI IDCHEBI:67677
ChEBI NameLongikaurin A
Stars
DefinitionA natural product found in Isodon adenolomus.
Last Modified22 September 2014
DownloadsMolfile
FormulaC20H28O5
Net Charge0
Average Mass348.439
Monoisotopic Mass348.19367
SMILES[H][C@@]12CC[C@]3([H])C(=C)C(=O)[C@@]1([C@@H]3O)[C@]1(O)OC[C@]23CCCC(C)(C)[C@@]3([H])[C@@H]1O
InChIInChI=1S/C20H28O5/c1-10-11-5-6-12-18-8-4-7-17(2,3)13(18)16(23)20(24,25-9-18)19(12,14(10)21)15(11)22/h11-13,15-16,22-24H,1,4-9H2,2-3H3/t11-,12+,13-,15-,16+,18-,19+,20-/m1/s1
InChIKeyPSVHVXLCVSKJGM-NIPWPZGFSA-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)
Longikaurin A (CHEBI:67677) has role metabolite (CHEBI:25212)
Longikaurin A (CHEBI:67677) is a kaurane diterpenoid (CHEBI:53666)
Synonym  Source
ent-Kaur-16-en-15-one, 7,20-epoxy-6,7,14-trihydroxy-,(6beta,7alpha,14R)-ChEBI
Registry NumbersSources
CAS:75207-67-9ChemIDplus
Citations