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CHEBI:227900 - Rhizopycnolide B

ChEBI IDCHEBI:227900
ChEBI NameRhizopycnolide B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H20O9
Net Charge0
Average Mass392.360
Monoisotopic Mass392.11073
SMILESCOc1cc(O)c2c(=O)oc3c(c2c1)[C@@](C)(O)C[C@H](OC)[C@@]31C[C@@H](O)C(=O)O1
InChIInChI=1S/C19H20O9/c1-18(24)7-12(26-3)19(6-11(21)16(22)28-19)15-14(18)9-4-8(25-2)5-10(20)13(9)17(23)27-15/h4-5,11-12,20-21,24H,6-7H2,1-3H3/t11-,12+,18+,19+/m1/s1
InChIKeyDXDVGVFRBGQXNB-GOCROKSSSA-N
Species of MetaboliteComponentSourceComments
Rhizopycnis (ncbitaxon:66822) - PubMed (27441892)
ChEBI Ontology
Outgoing Relation(s)
Rhizopycnolide B (CHEBI:227900) is a isocoumarins (CHEBI:38758)
IUPAC Name 
(1S,3S,3'R,4S)-1,3',7-trihydroxy-3,9-dimethoxy-1-methylspiro[2,3-dihydrobenzo[c]chromene-4,5'-oxolane]-2',6-dione
Manual XrefsDatabases
76771869ChemSpider