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CHEBI:200695 - Sartorypyrone B

ChEBI IDCHEBI:200695
ChEBI NameSartorypyrone B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H42O7
Net Charge0
Average Mass514.659
Monoisotopic Mass514.29305
SMILESCC(=O)O[C@H]1C[C@]2(C)[C@H]3CC[C@]4(C)Oc5oc(C)cc(=O)c5C[C@H]4[C@]3(C)CC[C@H]2C(C)(C)[C@H]1OC(C)=O
InChIInChI=1S/C30H42O7/c1-16-13-20(33)19-14-24-28(6)11-9-22-27(4,5)25(36-18(3)32)21(35-17(2)31)15-29(22,7)23(28)10-12-30(24,8)37-26(19)34-16/h13,21-25H,9-12,14-15H2,1-8H3/t21-,22-,23-,24-,25-,28+,29-,30-/m0/s1
InChIKeyDFAVZYUGRTVMCA-KNUPVKMWSA-N
Species of MetaboliteComponentSourceComments
Neosartorya (ncbitaxon:36629) - DOI (10.1016/j.tet.2013.07.078)
ChEBI Ontology
Outgoing Relation(s)
Sartorypyrone B (CHEBI:200695) is a organic heterotricyclic compound (CHEBI:26979)
Sartorypyrone B (CHEBI:200695) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
[(1R,2S,11S,14R,15R,17S,18R,20R)-18-acetyloxy-1,7,11,15,19,19-hexamethyl-5-oxo-8,10-dioxapentacyclo[12.8.0.02,11.04,9.015,20]docosa-4(9),6-dien-17-yl] acetate
Manual XrefsDatabases
30771090ChemSpider