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CHEBI:227750 - [(1R,3R,4R,5R,6R,7R,10R,13R)-7-chloro-6-hydroxy-10-methoxy-3,4,13-trimethyl-11,14-dioxatetracyclo[8.4.0.01,13.03,8]tetradec-8-en-5-yl] acetate

ChEBI IDCHEBI:227750
ChEBI Name[(1R,3R,4R,5R,6R,7R,10R,13R)-7-chloro-6-hydroxy-10-methoxy-3,4,13-trimethyl-11,14-dioxatetracyclo[8.4.0.01,13.03,8]tetradec-8-en-5-yl] acetate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H25ClO6
Net Charge0
Average Mass372.845
Monoisotopic Mass372.13397
SMILESCO[C@@]12C=C3[C@@H](Cl)[C@H](O)[C@H](OC(C)=O)[C@H](C)[C@@]3(C)C[C@]13O[C@]3(C)CO2
InChIInChI=1S/C18H25ClO6/c1-9-14(24-10(2)20)13(21)12(19)11-6-18(22-5)17(7-15(9,11)3)16(4,25-17)8-23-18/h6,9,12-14,21H,7-8H2,1-5H3/t9-,12+,13-,14+,15+,16+,17+,18+/m0/s1
InChIKeyOATSAFJJXLRNTB-ZLPPOCBDSA-N
Species of MetaboliteComponentSourceComments
Penicilliumspecies PR19N-1 (ncbitaxon:1327757) - PubMed (23612371)
ChEBI Ontology
Outgoing Relation(s)
[(1R,3R,4R,5R,6R,7R,10R,13R)-7-chloro-6-hydroxy-10-methoxy-3,4,13-trimethyl-11,14-dioxatetracyclo[8.4.0.01,13.03,8]tetradec-8-en-5-yl] acetate (CHEBI:227750) is a naphthofuran (CHEBI:39270)
IUPAC Name 
[(1R,3R,4R,5R,6R,7R,10R,13R)-7-chloro-6-hydroxy-10-methoxy-3,4,13-trimethyl-11,14-dioxatetracyclo[8.4.0.01,13.03,8]tetradec-8-en-5-yl] acetate
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