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

Details

Stereochemistry ACHIRAL
Molecular Formula C9H16O3
Molecular Weight 172.2215
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HEXACYCLONIC ACID

SMILES

OCC1(CC(O)=O)CCCCC1

InChI

InChIKey=WMJPAYUKEVEBCN-UHFFFAOYSA-N
InChI=1S/C9H16O3/c10-7-9(6-8(11)12)4-2-1-3-5-9/h10H,1-7H2,(H,11,12)

HIDE SMILES / InChI

Approval Year

Name Type Language
HEXACYCLONIC ACID
Common Name English
1-(HYDROXYMETHYL)CYCLOHEXANEACETATE
Systematic Name English
CYCLOHEXANEACETIC ACID, 1-(HYDROXYMETHYL)-
Common Name English
HEXACYCLONATE
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C47795
Created by admin on Fri Dec 15 16:57:27 UTC 2023 , Edited by admin on Fri Dec 15 16:57:27 UTC 2023
Code System Code Type Description
NCI_THESAURUS
C83747
Created by admin on Fri Dec 15 16:57:27 UTC 2023 , Edited by admin on Fri Dec 15 16:57:27 UTC 2023
PRIMARY
FDA UNII
2K0FP9UB6A
Created by admin on Fri Dec 15 16:57:27 UTC 2023 , Edited by admin on Fri Dec 15 16:57:27 UTC 2023
PRIMARY
CHEBI
167168
Created by admin on Fri Dec 15 16:57:27 UTC 2023 , Edited by admin on Fri Dec 15 16:57:27 UTC 2023
PRIMARY
CAS
7491-42-1
Created by admin on Fri Dec 15 16:57:27 UTC 2023 , Edited by admin on Fri Dec 15 16:57:27 UTC 2023
PRIMARY
WIKIPEDIA
HEXACYCLONATE
Created by admin on Fri Dec 15 16:57:27 UTC 2023 , Edited by admin on Fri Dec 15 16:57:27 UTC 2023
PRIMARY
PUBCHEM
23444
Created by admin on Fri Dec 15 16:57:27 UTC 2023 , Edited by admin on Fri Dec 15 16:57:27 UTC 2023
PRIMARY