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

Details

Stereochemistry ABSOLUTE
Molecular Formula C32H54O2
Molecular Weight 470.77
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CHOLESTERYL VALERATE

SMILES

CCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)[C@H](C)CCCC(C)C

InChI

InChIKey=RWTQCZGAMKTBRV-PTHRTHQKSA-N
InChI=1S/C32H54O2/c1-7-8-12-30(33)34-25-17-19-31(5)24(21-25)13-14-26-28-16-15-27(23(4)11-9-10-22(2)3)32(28,6)20-18-29(26)31/h13,22-23,25-29H,7-12,14-21H2,1-6H3/t23-,25+,26+,27-,28+,29+,31+,32-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
CHOLESTERYL PENTANOATE
Preferred Name English
CHOLESTERYL VALERATE
Common Name English
CHOLEST-5-EN-3-OL (3.BETA.)-, 3-PENTANOATE
Systematic Name English
Code System Code Type Description
CAS
7726-03-6
Created by admin on Wed Apr 02 06:42:30 GMT 2025 , Edited by admin on Wed Apr 02 06:42:30 GMT 2025
PRIMARY
FDA UNII
WJ4NKG39ZH
Created by admin on Wed Apr 02 06:42:30 GMT 2025 , Edited by admin on Wed Apr 02 06:42:30 GMT 2025
PRIMARY
PUBCHEM
111329
Created by admin on Wed Apr 02 06:42:30 GMT 2025 , Edited by admin on Wed Apr 02 06:42:30 GMT 2025
PRIMARY
EPA CompTox
DTXSID90998503
Created by admin on Wed Apr 02 06:42:30 GMT 2025 , Edited by admin on Wed Apr 02 06:42:30 GMT 2025
PRIMARY