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

Details

Stereochemistry ABSOLUTE
Molecular Formula C11H13NO6
Molecular Weight 255.224
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CARAMBOXIN

SMILES

COC1=CC(C[C@H](N)C(O)=O)=C(C(O)=O)C(O)=C1

InChI

InChIKey=DYJIDGJHOLTGBO-ZETCQYMHSA-N
InChI=1S/C11H13NO6/c1-18-6-2-5(3-7(12)10(14)15)9(11(16)17)8(13)4-6/h2,4,7,13H,3,12H2,1H3,(H,14,15)(H,16,17)/t7-/m0/s1

HIDE SMILES / InChI

Molecular Formula C11H13NO6
Molecular Weight 255.224
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:00:28 GMT 2023
Edited
by admin
on Sat Dec 16 18:00:28 GMT 2023
Record UNII
2EEY7DX8L2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CARAMBOXIN
Common Name English
2-CARBOXY-3-HYDROXY-5-METHOXY-L-PHENYLALANINE
Systematic Name English
L-PHENYLALANINE, 2-CARBOXY-3-HYDROXY-5-METHOXY-
Systematic Name English
Code System Code Type Description
CAS
1531600-36-8
Created by admin on Sat Dec 16 18:00:28 GMT 2023 , Edited by admin on Sat Dec 16 18:00:28 GMT 2023
PRIMARY
PUBCHEM
134728497
Created by admin on Sat Dec 16 18:00:28 GMT 2023 , Edited by admin on Sat Dec 16 18:00:28 GMT 2023
PRIMARY
WIKIPEDIA
Caramboxin
Created by admin on Sat Dec 16 18:00:28 GMT 2023 , Edited by admin on Sat Dec 16 18:00:28 GMT 2023
PRIMARY
FDA UNII
2EEY7DX8L2
Created by admin on Sat Dec 16 18:00:28 GMT 2023 , Edited by admin on Sat Dec 16 18:00:28 GMT 2023
PRIMARY
EPA CompTox
DTXSID801045762
Created by admin on Sat Dec 16 18:00:28 GMT 2023 , Edited by admin on Sat Dec 16 18:00:28 GMT 2023
PRIMARY