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

Details

Stereochemistry RACEMIC
Molecular Formula C39H73NO4
Molecular Weight 620.0012
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of 2-HYDROXY-3-(((9Z)-1-OXO-9-OCTADECEN-1-YL)AMINO)PROPYL (9Z)-9-OCTADECENOATE

SMILES

CCCCCCCC\C=C/CCCCCCCC(=O)NCC(O)COC(=O)CCCCCCC\C=C/CCCCCCCC

InChI

InChIKey=NVSOXBSZLWJJOA-CLFAGFIQSA-N
InChI=1S/C39H73NO4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(42)40-35-37(41)36-44-39(43)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,37,41H,3-16,21-36H2,1-2H3,(H,40,42)/b19-17-,20-18-

HIDE SMILES / InChI

Molecular Formula C39H73NO4
Molecular Weight 620.0012
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 2
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:08:52 GMT 2023
Edited
by admin
on Sat Dec 16 18:08:52 GMT 2023
Record UNII
29T8T3CEA8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-HYDROXY-3-(((9Z)-1-OXO-9-OCTADECEN-1-YL)AMINO)PROPYL (9Z)-9-OCTADECENOATE
Systematic Name English
OLEIC ACID AMINOPROPANEDIOL CERAMIDE
Common Name English
9-OCTADECENOIC ACID (9Z)-, 2-HYDROXY-3-(((9Z)-1-OXO-9-OCTADECEN-1-YL)AMINO)PROPYL ESTER
Systematic Name English
Code System Code Type Description
CAS
1141931-66-9
Created by admin on Sat Dec 16 18:08:52 GMT 2023 , Edited by admin on Sat Dec 16 18:08:52 GMT 2023
PRIMARY
FDA UNII
29T8T3CEA8
Created by admin on Sat Dec 16 18:08:52 GMT 2023 , Edited by admin on Sat Dec 16 18:08:52 GMT 2023
PRIMARY
PUBCHEM
25262385
Created by admin on Sat Dec 16 18:08:52 GMT 2023 , Edited by admin on Sat Dec 16 18:08:52 GMT 2023
PRIMARY