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

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (+)-(1(10)E,4E,6S,7R)-germacradien-6-ol
ChEBI ID CHEBI:137564
ChEBI ASCII Name (+)-(1(10)E,4E,6S,7R)-germacradien-6-ol
Definition A sesquiterpenoid obtained formally from (−)-germacrene A by hydroxylation at position 6 and hydrogenation across the C(11)-C(12) double bond.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C15H26O
Net Charge 0
Average Mass 222.372
Monoisotopic Mass 222.19837
InChI InChI=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
InChIKey PXMCURAOQSNMOZ-AHNWEQDZSA-N
SMILES CC(C)[C@H]1CC\C(C)=C\CC\C(C)=C\[C@H]1O
ChEBI Ontology
Outgoing (+)-(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
Synonym Source
(+)-(1(10)E,4E,6S,7R)-germacradien-6-ol UniProt
Manual Xref Database
CPD-20086 MetaCyc
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Registry Number Type Source
28758003 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
26361082 PubMed citation SUBMITTER
Last Modified
03 August 2020