U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C9H8O5
Molecular Weight 196.1568
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 2,4,5-TRIHYDROXYCINNAMIC ACID

SMILES

OC(=O)\C=C\C1=C(O)C=C(O)C(O)=C1

InChI

InChIKey=GUOJZFSYQUIYCN-OWOJBTEDSA-N
InChI=1S/C9H8O5/c10-6-4-8(12)7(11)3-5(6)1-2-9(13)14/h1-4,10-12H,(H,13,14)/b2-1+

HIDE SMILES / InChI

Molecular Formula C9H8O5
Molecular Weight 196.1568
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:57:04 GMT 2023
Edited
by admin
on Sat Dec 16 16:57:04 GMT 2023
Record UNII
JMT8N4J5PA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,4,5-TRIHYDROXYCINNAMIC ACID
Common Name English
(E)-3-(2,4,5-Trihydroxyphenyl)acrylic acid
Systematic Name English
2-Propenoic acid, 3-(2,4,5-trihydroxyphenyl)-, (2E)-
Systematic Name English
3-(2,4,5-Trihydroxyphenyl)-2-propenoic acid
Systematic Name English
2-Propenoic acid, 3-(2,4,5-trihydroxyphenyl)-
Systematic Name English
Code System Code Type Description
PUBCHEM
19968651
Created by admin on Sat Dec 16 16:57:04 GMT 2023 , Edited by admin on Sat Dec 16 16:57:04 GMT 2023
PRIMARY
FDA UNII
JMT8N4J5PA
Created by admin on Sat Dec 16 16:57:04 GMT 2023 , Edited by admin on Sat Dec 16 16:57:04 GMT 2023
PRIMARY
WIKIPEDIA
2,4,5-Trihydroxycinnamic acid
Created by admin on Sat Dec 16 16:57:04 GMT 2023 , Edited by admin on Sat Dec 16 16:57:04 GMT 2023
PRIMARY
CAS
56437-15-1
Created by admin on Sat Dec 16 16:57:04 GMT 2023 , Edited by admin on Sat Dec 16 16:57:04 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
CAS
2631046-97-2
Created by admin on Sat Dec 16 16:57:04 GMT 2023 , Edited by admin on Sat Dec 16 16:57:04 GMT 2023
PRIMARY