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

Details

Stereochemistry ACHIRAL
Molecular Formula C23H40O2
Molecular Weight 348.5625
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HEPTADECYLCATECHOL

SMILES

CCCCCCCCCCCCCCCCCC1=CC=CC(O)=C1O

InChI

InChIKey=DXRKLUVKXMAMOV-UHFFFAOYSA-N
InChI=1S/C23H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-19-17-20-22(24)23(21)25/h17,19-20,24-25H,2-16,18H2,1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
HEPTADECYLCATECHOL
Systematic Name English
3-HEPTADECYLCATECHOL
Systematic Name English
(17:0)-URUSHIOL [MI]
Common Name English
1,2-BENZENEDIOL, 3-HEPTADECYL-
Systematic Name English
Code System Code Type Description
MERCK INDEX
m11346
Created by admin on Sat Dec 16 09:14:46 GMT 2023 , Edited by admin on Sat Dec 16 09:14:46 GMT 2023
PRIMARY Merck Index
CAS
5862-27-1
Created by admin on Sat Dec 16 09:14:46 GMT 2023 , Edited by admin on Sat Dec 16 09:14:46 GMT 2023
PRIMARY
EPA CompTox
DTXSID60207331
Created by admin on Sat Dec 16 09:14:46 GMT 2023 , Edited by admin on Sat Dec 16 09:14:46 GMT 2023
PRIMARY
PUBCHEM
119222
Created by admin on Sat Dec 16 09:14:46 GMT 2023 , Edited by admin on Sat Dec 16 09:14:46 GMT 2023
PRIMARY
FDA UNII
29R0483XLZ
Created by admin on Sat Dec 16 09:14:46 GMT 2023 , Edited by admin on Sat Dec 16 09:14:46 GMT 2023
PRIMARY