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

Details

Stereochemistry ABSOLUTE
Molecular Formula C11H14O6
Molecular Weight 242.2253
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ELENOLIC ACID

SMILES

COC(=O)C1=CO[C@@H](C)[C@@H](C=O)[C@@H]1CC(O)=O

InChI

InChIKey=MQFAJBBHEYTHKF-BIIVOSGPSA-N
InChI=1S/C11H14O6/c1-6-8(4-12)7(3-10(13)14)9(5-17-6)11(15)16-2/h4-8H,3H2,1-2H3,(H,13,14)/t6-,7-,8+/m0/s1

HIDE SMILES / InChI

Molecular Formula C11H14O6
Molecular Weight 242.2253
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:02:08 GMT 2023
Edited
by admin
on Sat Dec 16 14:02:08 GMT 2023
Record UNII
5C9M8PFI8E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ELENOLIC ACID
Common Name English
(2S,3S,4S)-3-FORMYL-3,4-DIHYDRO-5-(METHOXYCARBONYL)-2-METHYL-2H-PYRAN-4-ACETIC ACID
Systematic Name English
2H-PYRAN-4-ACETIC ACID, 3-FORMYL-3,4-DIHYDRO-5-(METHOXYCARBONYL)-2-METHYL-, (2S,3S,4S)-
Systematic Name English
ELENAIC ACID
Common Name English
2H-PYRAN-4-ACETIC ACID, 3-FORMYL-3,4-DIHYDRO-5-(METHOXYCARBONYL)-2-METHYL-, (2S-(2.ALPHA.,3.ALPHA.,4.BETA.))-
Systematic Name English
Code System Code Type Description
CAS
34422-12-3
Created by admin on Sat Dec 16 14:02:08 GMT 2023 , Edited by admin on Sat Dec 16 14:02:08 GMT 2023
PRIMARY
EPA CompTox
DTXSID30188002
Created by admin on Sat Dec 16 14:02:08 GMT 2023 , Edited by admin on Sat Dec 16 14:02:08 GMT 2023
PRIMARY
FDA UNII
5C9M8PFI8E
Created by admin on Sat Dec 16 14:02:08 GMT 2023 , Edited by admin on Sat Dec 16 14:02:08 GMT 2023
PRIMARY
PUBCHEM
169607
Created by admin on Sat Dec 16 14:02:08 GMT 2023 , Edited by admin on Sat Dec 16 14:02:08 GMT 2023
PRIMARY
WIKIPEDIA
Elenolic acid
Created by admin on Sat Dec 16 14:02:08 GMT 2023 , Edited by admin on Sat Dec 16 14:02:08 GMT 2023
PRIMARY
IUPHAR
169607
Created by admin on Sat Dec 16 14:02:08 GMT 2023 , Edited by admin on Sat Dec 16 14:02:08 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT