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Details

Stereochemistry ACHIRAL
Molecular Formula C5H8O2
Molecular Weight 100.1158
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 2,3-DIMETHYLACRYLIC ACID, (E)-

SMILES

C\C=C(/C)C(O)=O

InChI

InChIKey=UIERETOOQGIECD-ONEGZZNKSA-N
InChI=1S/C5H8O2/c1-3-4(2)5(6)7/h3H,1-2H3,(H,6,7)/b4-3+

HIDE SMILES / InChI

Molecular Formula C5H8O2
Molecular Weight 100.1158
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Selective orthosteric free fatty acid receptor 2 (FFA2) agonists: identification of the structural and chemical requirements for selective activation of FFA2 versus FFA3.
2011 Mar 25
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 17:59:50 UTC 2023
Edited
by admin
on Fri Dec 15 17:59:50 UTC 2023
Record UNII
I5792N03HC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,3-DIMETHYLACRYLIC ACID, (E)-
Common Name English
NSC-8999
Code English
TIGLIC ACID
HSDB   MI  
Systematic Name English
METHYL-2-BUTENOIC ACID, TRANS-2-
Common Name English
(E)-2,3-DIMETHYLACRYLIC ACID
Systematic Name English
TRANS-.ALPHA.,.BETA.-DIMETHYLACRYLIC ACID
Common Name English
TRANS-2,3-DIMETHYLACRYLIC ACID
Common Name English
2-BUTENOIC ACID, 2-METHYL-, (2E)-
Common Name English
(E)-2-METHYLCROTONIC ACID
Systematic Name English
NSC-44235
Code English
CEVADIC ACID
Common Name English
2-METHYLBUT-2-ENOIC ACID, (E)-
Common Name English
TRANS-2-METHYL-2-BUTENOIC ACID
FHFI  
Common Name English
TRANS-2-METHYL-2-BUTENOIC ACID [FHFI]
Common Name English
CROTONIC ACID, 2-METHYL-, (E)-
Common Name English
E)-2-METHYLCROTONIC ACID
Common Name English
TIGLIC ACID [HSDB]
Common Name English
(E)-.ALPHA.-METHYLCROTONIC ACID
Systematic Name English
TIGLINIC ACID
Common Name English
TRANS-2-METHYLCROTONIC ACID
Common Name English
FEMA NO. 3599
Code English
(E)-2-METHYL-2-BUTENOIC ACID
Systematic Name English
TIGLIC ACID [MI]
Common Name English
Classification Tree Code System Code
JECFA EVALUATION TRANS-2-METHYL-2-BUTENOIC ACID
Created by admin on Fri Dec 15 17:59:50 UTC 2023 , Edited by admin on Fri Dec 15 17:59:50 UTC 2023
Code System Code Type Description
CAS
80-59-1
Created by admin on Fri Dec 15 17:59:50 UTC 2023 , Edited by admin on Fri Dec 15 17:59:50 UTC 2023
PRIMARY
JECFA MONOGRAPH
1214
Created by admin on Fri Dec 15 17:59:50 UTC 2023 , Edited by admin on Fri Dec 15 17:59:50 UTC 2023
PRIMARY
CHEBI
9592
Created by admin on Fri Dec 15 17:59:50 UTC 2023 , Edited by admin on Fri Dec 15 17:59:50 UTC 2023
PRIMARY
MERCK INDEX
m10859
Created by admin on Fri Dec 15 17:59:50 UTC 2023 , Edited by admin on Fri Dec 15 17:59:50 UTC 2023
PRIMARY Merck Index
CHEBI
36432
Created by admin on Fri Dec 15 17:59:50 UTC 2023 , Edited by admin on Fri Dec 15 17:59:50 UTC 2023
PRIMARY
DAILYMED
I5792N03HC
Created by admin on Fri Dec 15 17:59:50 UTC 2023 , Edited by admin on Fri Dec 15 17:59:50 UTC 2023
PRIMARY
NSC
8999
Created by admin on Fri Dec 15 17:59:50 UTC 2023 , Edited by admin on Fri Dec 15 17:59:50 UTC 2023
PRIMARY
RXCUI
1860614
Created by admin on Fri Dec 15 17:59:50 UTC 2023 , Edited by admin on Fri Dec 15 17:59:50 UTC 2023
PRIMARY
NSC
44235
Created by admin on Fri Dec 15 17:59:50 UTC 2023 , Edited by admin on Fri Dec 15 17:59:50 UTC 2023
PRIMARY
WIKIPEDIA
TIGLIC ACID
Created by admin on Fri Dec 15 17:59:50 UTC 2023 , Edited by admin on Fri Dec 15 17:59:50 UTC 2023
PRIMARY
EPA CompTox
DTXSID80883257
Created by admin on Fri Dec 15 17:59:50 UTC 2023 , Edited by admin on Fri Dec 15 17:59:50 UTC 2023
PRIMARY
PUBCHEM
125468
Created by admin on Fri Dec 15 17:59:50 UTC 2023 , Edited by admin on Fri Dec 15 17:59:50 UTC 2023
PRIMARY
HSDB
7614
Created by admin on Fri Dec 15 17:59:50 UTC 2023 , Edited by admin on Fri Dec 15 17:59:50 UTC 2023
PRIMARY
ECHA (EC/EINECS)
201-295-0
Created by admin on Fri Dec 15 17:59:50 UTC 2023 , Edited by admin on Fri Dec 15 17:59:50 UTC 2023
PRIMARY
FDA UNII
I5792N03HC
Created by admin on Fri Dec 15 17:59:50 UTC 2023 , Edited by admin on Fri Dec 15 17:59:50 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT
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PARENT -> CONSTITUENT ALWAYS PRESENT