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CHEBI:192243 - Yucalexin A19

ChEBI IDCHEBI:192243
ChEBI NameYucalexin A19
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H30O3
Net Charge0
Average Mass318.457
Monoisotopic Mass318.21949
SMILESCC1(O)CC23C=CC1CC2C1(C)CC(=O)C(O)C(C)(C)C1CC3
InChIInChI=1S/C20H30O3/c1-17(2)14-6-8-20-7-5-12(19(4,23)11-20)9-15(20)18(14,3)10-13(21)16(17)22/h5,7,12,14-16,22-23H,6,8-11H2,1-4H3
InChIKeyJHXMMAKVDKZILM-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Marine plankton environmental sample (ncbitaxon:632957) - MetaboLights (MTBLS4424) Found in endometabolome.
ChEBI Ontology
Outgoing Relation(s)
Yucalexin A19 (CHEBI:192243) has parent hydride atisane (CHEBI:36471)
Yucalexin A19 (CHEBI:192243) is a diterpenoid (CHEBI:23849)
IUPAC Name 
6,16-dihydroxy-5,5,9,16-tetramethyltetracyclo[10.2.2.01,10.04,9]hexadec-13-en-7-one
Manual XrefsDatabases
HMDB0036776HMDB
35014245ChemSpider