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CHEBI:208010 - Paecilomycin O

ChEBI IDCHEBI:208010
ChEBI NamePaecilomycin O
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H20O7
Net Charge0
Average Mass360.362
Monoisotopic Mass360.12090
SMILESCOc1cc(O)c2c(c1)[C@H]1O[C@@H]1CC1=C(O)C(=O)C[C@H]1C[C@H](C)OC2=O
InChIInChI=1S/C19H20O7/c1-8-3-9-4-14(21)17(22)11(9)7-15-18(26-15)12-5-10(24-2)6-13(20)16(12)19(23)25-8/h5-6,8-9,15,18,20,22H,3-4,7H2,1-2H3/t8-,9+,15+,18+/m0/s1
InChIKeyADTJGNWKVRRFSM-RTGCBJDCSA-N
Species of MetaboliteComponentSourceComments
Clavicipitaceaespecies SC0924 (ncbitaxon:1710628) - PubMed (28749671)
ChEBI Ontology
Outgoing Relation(s)
Paecilomycin O (CHEBI:208010) is a macrolide (CHEBI:25106)
Paecilomycin O (CHEBI:208010) is a resorcinols (CHEBI:33572)
IUPAC Name 
(2R,4R,10R,12S)-7,16-dihydroxy-18-methoxy-12-methyl-3,13-dioxatetracyclo[13.4.0.02,4.06,10]nonadeca-1(15),6,16,18-tetraene-8,14-dione
Manual XrefsDatabases
78438986ChemSpider