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CHEBI:209717 - Donghaecyclinone A

ChEBI IDCHEBI:209717
ChEBI NameDonghaecyclinone A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H18O5
Net Charge0
Average Mass338.359
Monoisotopic Mass338.11542
SMILESCOc1cccc2c1[C@@H]1Oc3ccc4c(c3[C@H]2O1)C(=O)C[C@@H](C)[C@@H]4O
InChIInChI=1S/C20H18O5/c1-9-8-12(21)15-10(18(9)22)6-7-14-17(15)19-11-4-3-5-13(23-2)16(11)20(24-14)25-19/h3-7,9,18-20,22H,8H2,1-2H3/t9-,18+,19+,20-/m1/s1
InChIKeyKERPHMLDJOZUCN-RWEXEPIUSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (32085561)
ChEBI Ontology
Outgoing Relation(s)
Donghaecyclinone A (CHEBI:209717) is a dibenzooxazepine (CHEBI:53802)
IUPAC Name 
(1S,6R,7S,13S)-7-hydroxy-15-methoxy-6-methyl-12,20-dioxapentacyclo[11.6.1.02,11.03,8.014,19]icosa-2(11),3(8),9,14(19),15,17-hexaen-4-one
Manual XrefsDatabases
81407956ChemSpider