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Details

Stereochemistry ABSOLUTE
Molecular Formula C41H81NO3
Molecular Weight 636.0867
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of N-((2R,3R)-1,3-BIS(OXIDANYL)OCTADEC-4-EN-2-YL)TRICOSANAMIDE

SMILES

CCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@H](O)\C=C\CCCCCCCCCCCCC

InChI

InChIKey=NAJHAHQNQCNWOP-PUYNVXOJSA-N
InChI=1S/C41H81NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-37-41(45)42-39(38-43)40(44)36-34-32-30-28-26-24-16-14-12-10-8-6-4-2/h34,36,39-40,43-44H,3-33,35,37-38H2,1-2H3,(H,42,45)/b36-34+/t39-,40+/m0/s1

HIDE SMILES / InChI

Molecular Formula C41H81NO3
Molecular Weight 636.0867
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 08:02:58 GMT 2025
Edited
by admin
on Wed Apr 02 08:02:58 GMT 2025
Record UNII
JA4WR98YCB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-((2R,3R)-1,3-BIS(OXIDANYL)OCTADEC-4-EN-2-YL)TRICOSANAMIDE
Preferred Name English
Code System Code Type Description
CAS
67605-84-9
Created by admin on Wed Apr 02 08:02:58 GMT 2025 , Edited by admin on Wed Apr 02 08:02:58 GMT 2025
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EPA CompTox
DTXSID10986967
Created by admin on Wed Apr 02 08:02:58 GMT 2025 , Edited by admin on Wed Apr 02 08:02:58 GMT 2025
PRIMARY
PUBCHEM
52931115
Created by admin on Wed Apr 02 08:02:58 GMT 2025 , Edited by admin on Wed Apr 02 08:02:58 GMT 2025
PRIMARY
FDA UNII
JA4WR98YCB
Created by admin on Wed Apr 02 08:02:58 GMT 2025 , Edited by admin on Wed Apr 02 08:02:58 GMT 2025
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