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CHEBI:225436 - Repraesentin F

ChEBI IDCHEBI:225436
ChEBI NameRepraesentin F
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O3
Net Charge0
Average Mass252.354
Monoisotopic Mass252.17254
SMILESCC(=O)[C@@H]1[C@@H]2C[C@](C)(CO)C[C@@H]2[C@@]2(C)CC[C@@]12O
InChIInChI=1S/C15H24O3/c1-9(17)12-10-6-13(2,8-16)7-11(10)14(3)4-5-15(12,14)18/h10-12,16,18H,4-8H2,1-3H3/t10-,11+,12-,13+,14-,15-/m1/s1
InChIKeyOIVNIOHZMJLJMA-ARSDKDGVSA-N
Species of MetaboliteComponentSourceComments
Lactarius repraesentaneus (ncbitaxon:239216) - PubMed (16794335)
ChEBI Ontology
Outgoing Relation(s)
Repraesentin F (CHEBI:225436) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
1-[(1S,2R,5R,6R,7R,9S)-5-hydroxy-9-(hydroxymethyl)-2,9-dimethyl-6-tricyclo[5.3.0.02,5]decanyl]ethanone
Manual XrefsDatabases
78437780ChemSpider