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CHEBI:211849 - Pasteurestin C

ChEBI IDCHEBI:211849
ChEBI NamePasteurestin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O3
Net Charge0
Average Mass250.338
Monoisotopic Mass250.15689
SMILESCC1(C)C[C@H]2[C@H](O)C(C(=O)O)=C3CC[C@]3(C)[C@H]2C1
InChIInChI=1S/C15H22O3/c1-14(2)6-8-10(7-14)15(3)5-4-9(15)11(12(8)16)13(17)18/h8,10,12,16H,4-7H2,1-3H3,(H,17,18)/t8-,10+,12+,15+/m1/s1
InChIKeyBLHWUDYFVHCFRU-KHNKHLGUSA-N
Species of MetaboliteComponentSourceComments
Cyclocybe aegerita (ncbitaxon:1973307) - PubMed (31164938)
ChEBI Ontology
Outgoing Relation(s)
Pasteurestin C (CHEBI:211849) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(4S,4aR,7aS,7bR)-4-hydroxy-6,6,7b-trimethyl-2,4,4a,5,7,7a-hexahydro-1H-cyclobuta[e]indene-3-carboxylic acid