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CHEBI:207590 - Brevione M

ChEBI IDCHEBI:207590
ChEBI NameBrevione M
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SubmitterMetaboLights
DownloadsMolfile
FormulaC27H34O5
Net Charge0
Average Mass438.564
Monoisotopic Mass438.24062
SMILESCC1=CC[C@@H]2[C@@]3(C)C=CC(=O)OC(C)(C)[C@@H]3CC[C@@]2(C)[C@]12Cc1c(c(C)c(C)oc1=O)O2
InChIInChI=1S/C27H34O5/c1-15-8-9-20-25(6)12-11-21(28)31-24(4,5)19(25)10-13-26(20,7)27(15)14-18-22(32-27)16(2)17(3)30-23(18)29/h8,11-12,19-20H,9-10,13-14H2,1-7H3/t19-,20+,25-,26+,27-/m0/s1
InChIKeyFJGNDLFUTLJNOP-YJHFSHLRSA-N
Species of MetaboliteComponentSourceComments
Aspergillus duricaulis (ncbitaxon:75552) - PubMed (26517152)
ChEBI Ontology
Outgoing Relation(s)
Brevione M (CHEBI:207590) is a pyranone (CHEBI:37963)
IUPAC Name 
(2S,5'aR,7'aR,11'aR,11'bR)-5',5',6,7,7'a,9',11'b-heptamethylspiro[3H-uro[3,2-c]pyran-2,8'-6,7,11,11a-tetrahydro-5aH-benzo[g][2]benzoxepine]-3',4-dione
Manual XrefsDatabases
58919007ChemSpider