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CHEBI:217519 - Monapinone D

ChEBI IDCHEBI:217519
ChEBI NameMonapinone D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H26O8
Net Charge0
Average Mass406.431
Monoisotopic Mass406.16277
SMILESCOc1cc(O)c2c(O)c3c(cc2c1)C[C@@H](CC(O)CC(O)CC(C)O)OC3=O
InChIInChI=1S/C21H26O8/c1-10(22)3-13(23)7-14(24)8-16-6-12-4-11-5-15(28-2)9-17(25)18(11)20(26)19(12)21(27)29-16/h4-5,9-10,13-14,16,22-26H,3,6-8H2,1-2H3/t10?,13?,14?,16-/m0/s1
InChIKeyUNRIUFZKWKVLAP-QCEIDJRWSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (21610716)
ChEBI Ontology
Outgoing Relation(s)
Monapinone D (CHEBI:217519) is a organic heterotricyclic compound (CHEBI:26979)
Monapinone D (CHEBI:217519) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(3S)-9,10-dihydroxy-7-methoxy-3-(2,4,6-trihydroxyheptyl)-3,4-dihydrobenzo[g]isochromen-1-one
Manual XrefsDatabases
78445287ChemSpider