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CHEBI:212592 - Dactylomelol

ChEBI IDCHEBI:212592
ChEBI NameDactylomelol
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SubmitterMetaboLights
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FormulaC20H34BrClO2
Net Charge0
Average Mass421.847
Monoisotopic Mass420.14307
SMILESC=CC(C)(O)CCC1C2(C)CCC(O2)C1(C)CC[C@H](Br)C(C)(C)Cl
InChIInChI=1S/C20H34BrClO2/c1-7-18(4,23)11-8-14-19(5,12-9-15(21)17(2,3)22)16-10-13-20(14,6)24-16/h7,14-16,23H,1,8-13H2,2-6H3/t14?,15-,16?,18?,19?,20?/m0/s1
InChIKeyVSSCBHMVVWLKMO-UPBIIEGVSA-N
ChEBI Ontology
Outgoing Relation(s)
Dactylomelol (CHEBI:212592) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
5-[3-[(3S)-3-bromo-4-chloro-4-methylpentyl]-1,3-dimethyl-7-oxabicyclo[2.2.1]heptan-2-yl]-3-methylpent-1-en-3-ol
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