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CHEBI:5337 - (1E,4E)-germacrene B

ChEBI IDCHEBI:5337
ChEBI Name(1E,4E)-germacrene B
Stars
ASCII Name(1E,4E)-germacrene B
Last Modified29 July 2017
DownloadsMolfile
FormulaC15H24
Net Charge0
Average Mass204.357
Monoisotopic Mass204.18780
SMILESCC(C)=C1C/C=C(\C)CC/C=C(\C)CC1
InChIInChI=1S/C15H24/c1-12(2)15-10-8-13(3)6-5-7-14(4)9-11-15/h6,9H,5,7-8,10-11H2,1-4H3/b13-6+,14-9+
InChIKeyGXEGJTGWYVZSNR-SJRHNVSNSA-N
Roles Classification
Biological Roles:
volatile oil component  Any plant metabolite that is found naturally as a component of a volatile oil.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
(1E,4E)-germacrene B (CHEBI:5337) is a germacrene B (CHEBI:49314)
IUPAC Names 
(1E,4E)-germacra-1(10),4,7(11)-triene
(1E,5E)-1,5-dimethyl-8-(propan-2-ylidene)cyclodeca-1,5-diene
Synonyms  Source
Germacrene BKEGG COMPOUND
germacra-1(10),4,7(11)-trieneNIST Chemistry WebBook
1,5-dimethyl-8-(1-methylethylidene)-1,5-cyclodecadieneNIST Chemistry WebBook
(E,E)-germacra-1(10),4,7(11)-trieneNIST Chemistry WebBook
(1E,5E)-8-isopropylidene-1,5-dimethylcyclodeca-1,5-dieneIUPAC
UniProt Name  Source
(1E,4E)-germacrene BUniProt
Manual XrefsDatabases
C09672KEGG COMPOUND
LMPR0103090007LIPID MAPS
C00003134KNApSAcK
Registry NumbersSources
Beilstein:2207171Beilstein
Gmelin:331381Gmelin
CAS:15423-57-1KEGG COMPOUND
CAS:15423-57-1ChemIDplus
CAS:15423-57-1NIST Chemistry WebBook