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CHEBI:143703 - thiogeraniol

ChEBI IDCHEBI:143703
ChEBI Namethiogeraniol
Stars
DefinitionA thiol that is geraniol in which the hydroxy group has been replaced by a thiol group.
Last Modified28 October 2020
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC10H18S
Net Charge0
Average Mass170.321
Monoisotopic Mass170.11292
SMILESCC(C)=CCC/C(C)=C/CS
InChIInChI=1S/C10H18S/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+
InChIKeyFACAUSJJVBMWLV-JXMROGBWSA-N
ChEBI Ontology
Outgoing Relation(s)
thiogeraniol (CHEBI:143703) is a monoterpenoid (CHEBI:25409)
thiogeraniol (CHEBI:143703) is a olefinic compound (CHEBI:78840)
thiogeraniol (CHEBI:143703) is a thiol (CHEBI:29256)
IUPAC Name 
(2E)-3,7-dimethylocta-2,6-diene-1-thiol
Synonyms  Source
geranyl mercaptanChemIDplus
thiogeraniolChemIDplus
(E)-3,7-dimethylocta-2,6-diene-1-thiolChemIDplus
UniProt Name  Source
(2E)-thiogeraniolUniProt
Manual XrefsDatabases
CPD-22373MetaCyc
FDB014950FooDB
HMDB0036106HMDB
Registry NumbersSources
CAS:39067-80-6ChemIDplus
Citations