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Details

Stereochemistry ACHIRAL
Molecular Formula C10H16O
Molecular Weight 152.2334
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of GERANIAL

SMILES

CC(C)=CCC\C(C)=C\C=O

InChI

InChIKey=WTEVQBCEXWBHNA-JXMROGBWSA-N
InChI=1S/C10H16O/c1-9(2)5-4-6-10(3)7-8-11/h5,7-8H,4,6H2,1-3H3/b10-7+

HIDE SMILES / InChI
Molecular Formula C10H16O
Molecular Weight 152.2334
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

2010
465
PubMed

PubMed

TitleDatePubMed
Antifungal properties of essential oils and their main components upon Cryptococcus neoformans.
1994 Dec
Assessment of estrogenic activity in some common essential oil constituents.
2002 Nov
Control of retinoic acid synthesis and FGF expression in the nasal pit is required to pattern the craniofacial skeleton.
2004 Dec 15
Analysis of the enzymatic formation of citral in the glands of sweet basil.
2006 Apr 15
Retinoids during the in vitro transition from bovine morula to blastocyst.
2006 Aug
The monoterpenoids citral and geraniol are moderate inhibitors of CYP2B6 hydroxylase activity.
2008 Aug 11
Effects of spice constituents on P-glycoprotein-mediated transport and CYP3A4-mediated metabolism in vitro.
2008 Jul
Citral sensing by Transient [corrected] receptor potential channels in dorsal root ganglion neurons.
2008 May 7
A new in vitro method for identifying chemical sensitizers combining peptide binding with ARE/EpRE-mediated gene expression in human skin cells.
2010 Sep
Fumigant antifungal activity of Myrtaceae essential oils and constituents from Leptospermum petersonii against three Aspergillus species.
2012 Sep 3
NCTC 2544 and IL-18 production: a tool for the identification of contact allergens.
2013 Apr
Differentiation of skin sensitizers from irritant chemicals by interleukin-1α and macrophage inflammatory protein-2 in murine keratinocytes.
2013 Jan 10
Genes specifically modulated in sensitized skins allow the detection of sensitizers in a reconstructed human skin model. Development of the SENS-IS assay.
2015 Jun
Chemical allergens stimulate human epidermal keratinocytes to produce lymphangiogenic vascular endothelial growth factor.
2015 Mar 1
Patents

Patents

04237072
2
06703527
7
08221736
2
JP2000053923A
3
JP2001114614A
3
JP2003245555A
2
JP2003529539A
2
JP2004123674A
11
JP2004123675A
11
JP2005239965A
2
JP2006006264A
2
JP2006290872A
5
JP2006510471A
3
JP2007063166A
2
JP2007282593A
3
JP2007302572A
2
JP2007525670A
148
JP2008280539A
3
JP2008297236A
2
JP2009139368A
2
JP2009280573A
2
JP2010254898A
4
JP2011240622A
2
JP2013209432A
2
JPH01294601A
8
JPH01311191A
5
JPH02117994A
4
JPH02275816A
5
JPH03127750A
2
JPH09309802A
2
JPH10120541A
3
JPH107511A
2
JPS5223014A
2
JPS56133280A
2
JPS6083544A
2
JPS6122037A
3
JPS62169741A
2
JPS6476815A
2
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:58:40 UTC 2023
Edited
by admin
on Fri Dec 15 15:58:40 UTC 2023
Record UNII
758ZMW724E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GERANIAL
Systematic Name English
(2E)-3,7-DIMETHYLOCTA-2,6-DIENAL
Systematic Name English
TRANS-CITRAL
Common Name English
CITRAL GERANIAL
MI  
Systematic Name English
CITRAL GERANIAL [MI]
Common Name English
CITRAL-A
Common Name English
CITRAL A
Common Name English
Code System Code Type Description
DAILYMED
758ZMW724E
Created by admin on Fri Dec 15 15:58:40 UTC 2023 , Edited by admin on Fri Dec 15 15:58:40 UTC 2023
PRIMARY
FDA UNII
758ZMW724E
Created by admin on Fri Dec 15 15:58:40 UTC 2023 , Edited by admin on Fri Dec 15 15:58:40 UTC 2023
PRIMARY
CHEBI
16980
Created by admin on Fri Dec 15 15:58:40 UTC 2023 , Edited by admin on Fri Dec 15 15:58:40 UTC 2023
PRIMARY
PUBCHEM
638011
Created by admin on Fri Dec 15 15:58:40 UTC 2023 , Edited by admin on Fri Dec 15 15:58:40 UTC 2023
PRIMARY
EPA CompTox
DTXSID20881217
Created by admin on Fri Dec 15 15:58:40 UTC 2023 , Edited by admin on Fri Dec 15 15:58:40 UTC 2023
PRIMARY
ECHA (EC/EINECS)
205-476-5
Created by admin on Fri Dec 15 15:58:40 UTC 2023 , Edited by admin on Fri Dec 15 15:58:40 UTC 2023
PRIMARY
MERCK INDEX
m3591
Created by admin on Fri Dec 15 15:58:40 UTC 2023 , Edited by admin on Fri Dec 15 15:58:40 UTC 2023
PRIMARY Merck Index
EVMPD
SUB62726
Created by admin on Fri Dec 15 15:58:40 UTC 2023 , Edited by admin on Fri Dec 15 15:58:40 UTC 2023
PRIMARY
CAS
141-27-5
Created by admin on Fri Dec 15 15:58:40 UTC 2023 , Edited by admin on Fri Dec 15 15:58:40 UTC 2023
PRIMARY
SMS_ID
100000134492
Created by admin on Fri Dec 15 15:58:40 UTC 2023 , Edited by admin on Fri Dec 15 15:58:40 UTC 2023
PRIMARY
RXCUI
2119367
Created by admin on Fri Dec 15 15:58:40 UTC 2023 , Edited by admin on Fri Dec 15 15:58:40 UTC 2023
PRIMARY
MESH
C007076
Created by admin on Fri Dec 15 15:58:40 UTC 2023 , Edited by admin on Fri Dec 15 15:58:40 UTC 2023
PRIMARY
Related Record Type Details
JAVA CITRONELLA OIL
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PARENT -> CONSTITUENT ALWAYS PRESENT
ASSAY (GC)
NIH
NCATS
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