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Details

Stereochemistry ACHIRAL
Molecular Formula C26H39NO2
Molecular Weight 397.5934
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 3
Charge 0

SHOW SMILES / InChI
Structure of N-((3-METHOXYPHENYL)METHYL)OCTADECA-9,12,15-TRIENAMIDE, (9Z,12Z,15Z)-

SMILES

CC\C=C/C\C=C/C\C=C/CCCCCCCC(=O)NCC1=CC(OC)=CC=C1

InChI

InChIKey=XKHCEDYSKNATME-YSTUJMKBSA-N
InChI=1S/C26H39NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-26(28)27-23-24-19-18-20-25(22-24)29-2/h4-5,7-8,10-11,18-20,22H,3,6,9,12-17,21,23H2,1-2H3,(H,27,28)/b5-4-,8-7-,11-10-

HIDE SMILES / InChI

Molecular Formula C26H39NO2
Molecular Weight 397.5934
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 3
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 02:06:31 GMT 2023
Edited
by admin
on Sat Dec 16 02:06:31 GMT 2023
Record UNII
FZ9FWW7N2Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-((3-METHOXYPHENYL)METHYL)OCTADECA-9,12,15-TRIENAMIDE, (9Z,12Z,15Z)-
Systematic Name English
9,12,15-OCTADECATRIENAMIDE, N-((3-METHOXYPHENYL)METHYL)-, (9Z,12Z,15Z)-
Systematic Name English
N-(3-METHOXYBENZYL)-(9Z,12Z,15Z)-OCTADECATRIENAMIDE
Common Name English
(9Z,12Z,15Z)-N-((3-METHOXYPHENYL)METHYL)-9,12,15-OCTADECATRIENAMIDE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID701161220
Created by admin on Sat Dec 16 02:06:31 GMT 2023 , Edited by admin on Sat Dec 16 02:06:31 GMT 2023
PRIMARY
CAS
883715-23-9
Created by admin on Sat Dec 16 02:06:31 GMT 2023 , Edited by admin on Sat Dec 16 02:06:31 GMT 2023
PRIMARY
FDA UNII
FZ9FWW7N2Q
Created by admin on Sat Dec 16 02:06:31 GMT 2023 , Edited by admin on Sat Dec 16 02:06:31 GMT 2023
PRIMARY
PUBCHEM
73353637
Created by admin on Sat Dec 16 02:06:31 GMT 2023 , Edited by admin on Sat Dec 16 02:06:31 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT
AEA transport IC50 = 100 uM; FAAH activity IC50 = 19.1 +- 3.7 uM