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CHEBI:223319 - Terreolide C

ChEBI IDCHEBI:223319
ChEBI NameTerreolide C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC32H46O8
Net Charge0
Average Mass558.712
Monoisotopic Mass558.31927
SMILESC=C1CC[C@@H](CC[C@H]2CC[C@]3(OC2)O[C@H]2C[C@]3(C)OC(C)(C)C2=O)C(C)(C)[C@H]1[C@H](C=C1CCOC1=O)OC(C)=O
InChIInChI=1S/C32H46O8/c1-19-8-10-23(29(3,4)26(19)24(38-20(2)33)16-22-13-15-36-28(22)35)11-9-21-12-14-32(37-18-21)31(7)17-25(39-32)27(34)30(5,6)40-31/h16,21,23-26H,1,8-15,17-18H2,2-7H3/t21-,23-,24-,25-,26+,31-,32-/m0/s1
InChIKeyUNZYNNXFBCZNTE-SGDAVDGUSA-N
Species of MetaboliteComponentSourceComments
Tricholoma terreum (ncbitaxon:76328) - PubMed (24753190)
ChEBI Ontology
Outgoing Relation(s)
Terreolide C (CHEBI:223319) is a oxacycle (CHEBI:38104)
IUPAC Name 
[(1S)-1-[(1S,3R)-2,2-dimethyl-6-methylidene-3-[2-[(1S,3'S,5S,7S)-1,3,3-trimethyl-4-oxospiro[2,6-dioxabicyclo[3.2.1]octane-7,6'-oxane]-3'-yl]ethyl]cyclohexyl]-2-(2-oxooxolan-3-ylidene)ethyl] acetate
Manual XrefsDatabases
78441205ChemSpider