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CHEBI:206506 - Rhinoclactone E

ChEBI IDCHEBI:206506
ChEBI NameRhinoclactone E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H25ClO7
Net Charge0
Average Mass412.866
Monoisotopic Mass412.12888
SMILESCOc1cc(O)c(Cl)c2c1C(=O)O[C@@H](C)CCC(=O)CC[C@@H](OC)CC(=O)C2
InChIInChI=1S/C20H25ClO7/c1-11-4-5-12(22)6-7-14(26-2)8-13(23)9-15-18(20(25)28-11)17(27-3)10-16(24)19(15)21/h10-11,14,24H,4-9H2,1-3H3/t11-,14+/m0/s1
InChIKeyDEMKQUIZOFIHRZ-SMDDNHRTSA-N
Species of MetaboliteComponentSourceComments
Rhinocladiella similis (ncbitaxon:319420) - PubMed (30974765)
ChEBI Ontology
Outgoing Relation(s)
Rhinoclactone E (CHEBI:206506) is a macrolide (CHEBI:25106)
IUPAC Name 
(4S,10R)-15-chloro-16-hydroxy-10,18-dimethoxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(18),14,16-triene-2,7,12-trione