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CHEBI:208975 - Eremofortin F

ChEBI IDCHEBI:208975
ChEBI NameEremofortin F
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SubmitterMetaboLights
DownloadsMolfile
FormulaC26H38O6
Net Charge0
Average Mass446.584
Monoisotopic Mass446.26684
SMILESC=C(C)[C@@H]1C[C@@]2(CO)C(=CC1=O)CC[C@@H](OC(=O)C(C)C(O)/C=C/C=C/CC(C)O)[C@@H]2C
InChIInChI=1S/C26H38O6/c1-16(2)21-14-26(15-27)19(5)24(12-11-20(26)13-23(21)30)32-25(31)18(4)22(29)10-8-6-7-9-17(3)28/h6-8,10,13,17-19,21-22,24,27-29H,1,9,11-12,14-15H2,2-5H3/b7-6+,10-8+/t17?,18?,19-,21-,22?,24+,26-/m0/s1
InChIKeyLSVIDWGNANJIBB-BFBLSFCDSA-N
Species of MetaboliteComponentSourceComments
Diaporthe (ncbitaxon:36922) - PubMed (26149922)
ChEBI Ontology
Outgoing Relation(s)
Eremofortin F (CHEBI:208975) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
[(1R,2R,7S,8aS)-8a-(hydroxymethyl)-1-methyl-6-oxo-7-prop-1-en-2-yl-1,2,3,4,7,8-hexahydronaphthalen-2-yl] (4E,6E)-3,9-dihydroxy-2-methyldeca-4,6-dienoate
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