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

Details

Stereochemistry RACEMIC
Molecular Formula C12H16O4
Molecular Weight 224.253
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FEPENTOLIC ACID

SMILES

CCCCC(O)C1=CC(=CC=C1O)C(O)=O

InChI

InChIKey=SQHQDVNANXVULC-UHFFFAOYSA-N
InChI=1S/C12H16O4/c1-2-3-4-10(13)9-7-8(12(15)16)5-6-11(9)14/h5-7,10,13-14H,2-4H2,1H3,(H,15,16)

HIDE SMILES / InChI
Name Type Language
FEPENTOLIC ACID
INN  
INN  
Official Name English
BENZOIC ACID, 4-HYDROXY-3-(1-HYDROXYPENTYL)-
Systematic Name English
RCM-258
Code English
.ALPHA.-BUTYL-.ALPHA.-HYDROXY-4,3-CRESOTIC ACID
Common Name English
RCM 258
Code English
fepentolic acid [INN]
Common Name English
R. C. M. 258
Code English
Code System Code Type Description
EVMPD
SUB07604MIG
Created by admin on Fri Dec 15 16:01:58 GMT 2023 , Edited by admin on Fri Dec 15 16:01:58 GMT 2023
PRIMARY
FDA UNII
2Y3Q6049LX
Created by admin on Fri Dec 15 16:01:58 GMT 2023 , Edited by admin on Fri Dec 15 16:01:58 GMT 2023
PRIMARY
ChEMBL
CHEMBL2104375
Created by admin on Fri Dec 15 16:01:58 GMT 2023 , Edited by admin on Fri Dec 15 16:01:58 GMT 2023
PRIMARY
EPA CompTox
DTXSID201043168
Created by admin on Fri Dec 15 16:01:58 GMT 2023 , Edited by admin on Fri Dec 15 16:01:58 GMT 2023
PRIMARY
NCI_THESAURUS
C45678
Created by admin on Fri Dec 15 16:01:58 GMT 2023 , Edited by admin on Fri Dec 15 16:01:58 GMT 2023
CONCEPT Industrial Aid
INN
2466
Created by admin on Fri Dec 15 16:01:58 GMT 2023 , Edited by admin on Fri Dec 15 16:01:58 GMT 2023
PRIMARY
SMS_ID
100000080957
Created by admin on Fri Dec 15 16:01:58 GMT 2023 , Edited by admin on Fri Dec 15 16:01:58 GMT 2023
PRIMARY
CAS
17243-33-3
Created by admin on Fri Dec 15 16:01:58 GMT 2023 , Edited by admin on Fri Dec 15 16:01:58 GMT 2023
PRIMARY
NCI_THESAURUS
C72094
Created by admin on Fri Dec 15 16:01:58 GMT 2023 , Edited by admin on Fri Dec 15 16:01:58 GMT 2023
PRIMARY
PUBCHEM
10466191
Created by admin on Fri Dec 15 16:01:58 GMT 2023 , Edited by admin on Fri Dec 15 16:01:58 GMT 2023
PRIMARY