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CHEBI:199280 - Parnafungin A1

ChEBI IDCHEBI:199280
ChEBI NameParnafungin A1
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SubmitterMetaboLights
DownloadsMolfile
FormulaC23H17NO9
Net Charge0
Average Mass451.387
Monoisotopic Mass451.09033
SMILESCOC(=O)[C@]12Oc3cc4c(c(O)c3C(O)=C1C(=O)CC[C@@H]2O)-c1cccc2c(=O)on(c12)C4
InChIInChI=1S/C23H17NO9/c1-31-22(30)23-14(26)6-5-12(25)17(23)20(28)16-13(32-23)7-9-8-24-18-10(15(9)19(16)27)3-2-4-11(18)21(29)33-24/h2-4,7,14,26-28H,5-6,8H2,1H3/t14-,23+/m0/s1
InChIKeyJYGGQRZQMPCWOX-LFVRLGFBSA-N
Species of MetaboliteComponentSourceComments
Microcera larvarum (ncbitaxon:1053158) - PubMed (18461935)
ChEBI Ontology
Outgoing Relation(s)
Parnafungin A1 (CHEBI:199280) is a pyridochromene (CHEBI:53792)
IUPAC Name 
methyl (10S,11S)-3,5,10-trihydroxy-7,19-dioxo-12,18-dioxa-17-azahexacyclo[15.6.1.02,15.04,13.06,11.020,24]tetracosa-1(23),2,4(13),5,14,20(24),21-heptaene-11-carboxylate
Manual XrefsDatabases
78436483ChemSpider