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CHEBI:137564 - (+)-(1(10)E,4E,6S,7R)-germacradien-6-ol

ChEBI IDCHEBI:137564
ChEBI Name(+)-(1(10)E,4E,6S,7R)-germacradien-6-ol
Stars
ASCII Name(+)-(1(10)E,4E,6S,7R)-germacradien-6-ol
DefinitionA sesquiterpenoid obtained formally from (−)-germacrene A by hydroxylation at position 6 and hydrogenation across the C(11)-C(12) double bond.
Last Modified3 August 2020
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC15H26O
Net Charge0
Average Mass222.372
Monoisotopic Mass222.19837
SMILESC/C1=C\[C@@H](O)[C@@H](C(C)C)CC/C(C)=C/CC1
InChIInChI=1S/C15H26O/c1-11(2)14-9-8-12(3)6-5-7-13(4)10-15(14)16/h6,10-11,14-16H,5,7-9H2,1-4H3/b12-6+,13-10+/t14-,15-/m1/s1
InChIKeyPXMCURAOQSNMOZ-AHNWEQDZSA-N
ChEBI Ontology
Outgoing Relation(s)
(+)-(1(10)E,4E,6S,7R)-germacradien-6-ol (CHEBI:137564) has parent hydride (−)-germacrene A (CHEBI:36515)
(+)-(1(10)E,4E,6S,7R)-germacradien-6-ol (CHEBI:137564) is a secondary allylic alcohol (CHEBI:134396)
(+)-(1(10)E,4E,6S,7R)-germacradien-6-ol (CHEBI:137564) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1S,2E,6E,10R)-3,7-dimethyl-10-(propan-2-yl)cyclodeca-2,6-dien-1-ol
UniProt Name  Source
(+)-(1(10)E,4E,6S,7R)-germacradien-6-olUniProt
Manual XrefsDatabases
CPD-20086MetaCyc
Registry NumbersSources
Reaxys:28758003Reaxys
Citations