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CHEBI:213473 - Arthpyrone D

ChEBI IDCHEBI:213473
ChEBI NameArthpyrone D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H31NO7
Net Charge0
Average Mass445.512
Monoisotopic Mass445.21005
SMILESC[C@@H]1CC[C@H]2[C@H](C(=O)Oc3c4c(cnc3=O)[C@]3(O)CC[C@H](O)[C@H](O4)[C@@H]3O)[C@H](C)C=C[C@@H]2C1
InChIInChI=1S/C24H31NO7/c1-11-3-6-14-13(9-11)5-4-12(2)17(14)23(29)32-20-18-15(10-25-22(20)28)24(30)8-7-16(26)19(31-18)21(24)27/h4-5,10-14,16-17,19,21,26-27,30H,3,6-9H2,1-2H3,(H,25,28)/t11-,12-,13-,14-,16+,17-,19+,21+,24-/m1/s1
InChIKeyIVQSLLHVPILGQY-CSCCFPDDSA-N
Species of MetaboliteComponentSourceComments
Arthrinium (ncbitaxon:112177) - PubMed (29786655)
ChEBI Ontology
Outgoing Relation(s)
Arthpyrone D (CHEBI:213473) is a pyranopyridine (CHEBI:38192)
IUPAC Name 
[(1R,9S,10S,13S)-1,10,13-trihydroxy-5-oxo-8-oxa-4-azatricyclo[7.3.1.02,7]trideca-2,6-dien-6-yl] (1R,2R,4aS,6R,8aR)-2,6-dimethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalene-1-carboxylate
Manual XrefsDatabases
71048974ChemSpider