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CHEBI:201831 - A88696D

ChEBI IDCHEBI:201831
ChEBI NameA88696D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC22H32O4
Net Charge0
Average Mass360.494
Monoisotopic Mass360.23006
SMILESCC[C@@H]1C[C@@]23OC(=O)[C@]4(O[C@H]4[C@@H](C)C[C@H](C)CCC[C@]2(C)C=C1C)C3=O
InChIInChI=1S/C22H32O4/c1-6-16-12-21-18(23)22(19(24)26-21)17(25-22)14(3)10-13(2)8-7-9-20(21,5)11-15(16)4/h11,13-14,16-17H,6-10,12H2,1-5H3/t13-,14+,16-,17+,20-,21+,22-/m1/s1
InChIKeyRRVPBWBDQBVHHW-IZIWQKFHSA-N
Species of MetaboliteComponentSourceComments
Streptomyces sclerotialus (ncbitaxon:1957) - DOI (10.1016/s0040-4039(00)61494-6)
ChEBI Ontology
Outgoing Relation(s)
A88696D (CHEBI:201831) is a γ-lactone (CHEBI:37581)
IUPAC Name 
(1R,3S,4S,6R,10R,13R,15R)-13-ethyl-4,6,10,12-tetramethyl-2,16-dioxatetracyclo[13.2.1.01,3.010,15]octadec-11-ene-17,18-dione
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78440114ChemSpider