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CHEBI:212380 - Zosteropenilline K

ChEBI IDCHEBI:212380
ChEBI NameZosteropenilline K
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O5
Net Charge0
Average Mass282.336
Monoisotopic Mass282.14672
SMILESC[C@@]1(O)C(=O)C=C2C[C@@H](CO)CC[C@@H]2[C@H]1C(=O)CCO
InChIInChI=1S/C15H22O5/c1-15(20)13(19)7-10-6-9(8-17)2-3-11(10)14(15)12(18)4-5-16/h7,9,11,14,16-17,20H,2-6,8H2,1H3/t9-,11-,14-,15+/m0/s1
InChIKeyZVVBHCPWACWQFB-LHAJWOIZSA-N
Species of MetaboliteComponentSourceComments
Penicillium thomii (ncbitaxon:36647) - PubMed (28218691)
ChEBI Ontology
Outgoing Relation(s)
Zosteropenilline K (CHEBI:212380) is a cyclohexenones (CHEBI:48953)
IUPAC Name 
(3S,4R,4aR,7S)-3-hydroxy-7-(hydroxymethyl)-4-(3-hydroxypropanoyl)-3-methyl-4,4a,5,6,7,8-hexahydronaphthalen-2-one
Manual XrefsDatabases
61362096ChemSpider