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CHEBI:215907 - [(1aR,6aR,7S,7aR)-3,3,6a,7a-tetramethyl-2-oxo-1a,2a,4,5,6,7-hexahydronaphtho[2,3-b]oxiren-7-yl]methyl 6-oxooctadecanoate

ChEBI IDCHEBI:215907
ChEBI Name[(1aR,6aR,7S,7aR)-3,3,6a,7a-tetramethyl-2-oxo-1a,2a,4,5,6,7-hexahydronaphtho[2,3-b]oxiren-7-yl]methyl 6-oxooctadecanoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC33H56O5
Net Charge0
Average Mass532.806
Monoisotopic Mass532.41277
SMILESCCCCCCCCCCCCC(=O)CCCCC(=O)OC[C@H]1[C@@]2(C)O[C@H]2C(=O)C2C(C)(C)CCC[C@@]21C
InChIInChI=1S/C33H56O5/c1-6-7-8-9-10-11-12-13-14-15-19-25(34)20-16-17-21-27(35)37-24-26-32(4)23-18-22-31(2,3)29(32)28(36)30-33(26,5)38-30/h26,29-30H,6-24H2,1-5H3/t26-,29?,30+,32-,33-/m1/s1
InChIKeyPNYHEXNHQQZZLO-JUAIBCHFSA-N
Species of MetaboliteComponentSourceComments
Lactarius uvidus (ncbitaxon:152949) - PubMed (7964786)
ChEBI Ontology
Outgoing Relation(s)
[(1aR,6aR,7S,7aR)-3,3,6a,7a-tetramethyl-2-oxo-1a,2a,4,5,6,7-hexahydronaphtho[2,3-b]oxiren-7-yl]methyl 6-oxooctadecanoate (CHEBI:215907) is a oxacycle (CHEBI:38104)
IUPAC Name 
[(1aR,6aR,7S,7aR)-3,3,6a,7a-tetramethyl-2-oxo-1a,2a,4,5,6,7-hexahydronaphtho[2,3-b]oxiren-7-yl]methyl 6-oxooctadecanoate
Manual XrefsDatabases
8251299ChemSpider