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

Details

Stereochemistry ABSOLUTE
Molecular Formula C42H85NO4
Molecular Weight 668.1286
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-Lignoceroyl Phytosphingosine

SMILES

CCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@H](O)[C@H](O)CCCCCCCCCCCCCC

InChI

InChIKey=ZESJDNWGTANZCC-LFVSMIGWSA-N
InChI=1S/C42H85NO4/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-27-29-31-33-35-37-41(46)43-39(38-44)42(47)40(45)36-34-32-30-28-26-16-14-12-10-8-6-4-2/h39-40,42,44-45,47H,3-38H2,1-2H3,(H,43,46)/t39-,40+,42-/m0/s1

HIDE SMILES / InChI

Molecular Formula C42H85NO4
Molecular Weight 668.1286
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 21:22:50 GMT 2025
Edited
by admin
on Wed Apr 02 21:22:50 GMT 2025
Record UNII
E85PSH5VMB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
C24 Phytoceramide (t18:0/24:0)
Preferred Name English
N-Lignoceroyl Phytosphingosine
Systematic Name English
Tetracosanamide, N-[(1S,2S,3R)-2,3-dihydroxy-1-(hydroxymethyl)heptadecyl]-
Systematic Name English
N-[(1S,2S,3R)-2,3-Dihydroxy-1-(hydroxymethyl)heptadecyl]tetracosanamide
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID901216287
Created by admin on Wed Apr 02 21:22:50 GMT 2025 , Edited by admin on Wed Apr 02 21:22:50 GMT 2025
PRIMARY
CAS
34437-74-6
Created by admin on Wed Apr 02 21:22:50 GMT 2025 , Edited by admin on Wed Apr 02 21:22:50 GMT 2025
PRIMARY
FDA UNII
E85PSH5VMB
Created by admin on Wed Apr 02 21:22:50 GMT 2025 , Edited by admin on Wed Apr 02 21:22:50 GMT 2025
PRIMARY
PUBCHEM
10462091
Created by admin on Wed Apr 02 21:22:50 GMT 2025 , Edited by admin on Wed Apr 02 21:22:50 GMT 2025
PRIMARY