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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H44O3
Molecular Weight 344.5723
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BATILOL, (S)-

SMILES

CCCCCCCCCCCCCCCCCCOC[C@@H](O)CO

InChI

InChIKey=OGBUMNBNEWYMNJ-NRFANRHFSA-N
InChI=1S/C21H44O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-20-21(23)19-22/h21-23H,2-20H2,1H3/t21-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H44O3
Molecular Weight 344.5723
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:02:41 GMT 2023
Edited
by admin
on Sat Dec 16 09:02:41 GMT 2023
Record UNII
05A230LN91
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BATILOL, (S)-
Common Name English
1,2-PROPANEDIOL, 3-(OCTADECYLOXY)-, (2S)-
Systematic Name English
Code System Code Type Description
CAS
6129-13-1
Created by admin on Sat Dec 16 09:02:41 GMT 2023 , Edited by admin on Sat Dec 16 09:02:41 GMT 2023
PRIMARY
EPA CompTox
DTXSID10446238
Created by admin on Sat Dec 16 09:02:41 GMT 2023 , Edited by admin on Sat Dec 16 09:02:41 GMT 2023
PRIMARY
FDA UNII
05A230LN91
Created by admin on Sat Dec 16 09:02:41 GMT 2023 , Edited by admin on Sat Dec 16 09:02:41 GMT 2023
PRIMARY
PUBCHEM
10860876
Created by admin on Sat Dec 16 09:02:41 GMT 2023 , Edited by admin on Sat Dec 16 09:02:41 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER