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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:138043 - (2
E
,6
E
)-hedycaryol
Main
ChEBI Ontology
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ChEBI Name
(2
E
,6
E
)-hedycaryol
ChEBI ID
CHEBI:138043
ChEBI ASCII Name
(2E,6E)-hedycaryol
Definition
A germacrane sesquiterpenoid that is germacra-1(10),4-diene carrying an additional hydroxy substituent at position 11.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Kristian Axelsen
Supplier Information
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Formula
C15H26O
Net Charge
0
Average Mass
222.372
Monoisotopic Mass
222.19837
InChI
InChI=1S/C15H26O/c1-
12-
6-
5-
7-
13(2)
9-
11-
14(10-
8-
12)
15(3,4)
16/h6,9,14,16H,5,7-
8,10-
11H2,1-
4H3/b12-
6+,13-
9+/t14-
/m1/s1
InChIKey
SDMLCXJKAYFHQM-MKJLVJGCSA-N
SMILES
C\C1=C/CC\C(C)=C\C[C@@H](CC1)C(C)(C)O
Metabolite of Species
Details
Cymbopogon validus
(IPNI:397032-1)
Found in flower
(BTO:0000469)
. See:
PubMed
Cymbopogon validus
(IPNI:397032-1)
Found in leaf
(BTO:0000713)
. See:
PubMed
Curcuma longa
(NCBI:txid136217)
Isolated from the essential oil See:
PubMed
Citrus hystrix
(NCBI:txid170989)
Found in leaf
(BTO:0000713)
. See:
PubMed
Xanthocyparis vietnamensis
(NCBI:txid257623)
Found in leaf
(BTO:0000713)
. See:
PubMed
Camellia brevistyla
(NCBI:txid296050)
Found in flower
(BTO:0000469)
. See:
PubMed
Zingiber officinale
(NCBI:txid94328)
Isolated from the essential oil See:
PubMed
Roles Classification
Biological Role
(s):
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
volatile oil component
Any plant metabolite that is found naturally as a component of a volatile oil.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
(2
E
,6
E
)-hedycaryol (
CHEBI:138043
)
has role
plant metabolite (
CHEBI:76924
)
(2
E
,6
E
)-hedycaryol (
CHEBI:138043
)
has role
volatile oil component (
CHEBI:27311
)
(2
E
,6
E
)-hedycaryol (
CHEBI:138043
)
is a
germacrane sesquiterpenoid (
CHEBI:68588
)
(2
E
,6
E
)-hedycaryol (
CHEBI:138043
)
is a
tertiary alcohol (
CHEBI:26878
)
IUPAC Name
2-[(1
R
,3
E
,7
E
)-4,8-dimethylcyclodeca-3,7-dien-1-yl]propan-2-ol
Synonyms
Sources
(+)-hedycaryol
ChEBI
(1
E
,4
E
,7
R
)-germacra-1(10),4-dien-11-ol
ChEBI
(2
E
,6
E
)-hedycaryol
UniProt
Manual Xref
Database
CPD-20143
MetaCyc
View more database links
Registry Number
Type
Source
2258683
Reaxys Registry Number
Reaxys
Citations
Types
Sources
23272109
PubMed citation
SUBMITTER
26744017
PubMed citation
SUBMITTER
27261849
PubMed citation
Europe PMC
27355937
PubMed citation
Europe PMC
28930124
PubMed citation
Europe PMC
Last Modified
03 August 2020