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

Details

Stereochemistry ABSOLUTE
Molecular Formula C27H44O
Molecular Weight 384.6377
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 8-DEHYDROCHOLESTEROL

SMILES

CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3=C(CC[C@]12C)[C@@]4(C)CC[C@H](O)CC4=CC3

InChI

InChIKey=VUKORTMHZDZZFR-BXAZICILSA-N
InChI=1S/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21,23-24,28H,6-8,10-17H2,1-5H3/t19-,21+,23-,24+,26+,27-/m1/s1

HIDE SMILES / InChI

Molecular Formula C27H44O
Molecular Weight 384.6377
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 06:17:46 GMT 2025
Edited
by admin
on Wed Apr 02 06:17:46 GMT 2025
Record UNII
R85BA49SYS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(3.BETA.)-CHOLESTA-5,8-DIEN-3-OL
Preferred Name English
8-DEHYDROCHOLESTEROL
Common Name English
CHOLESTA-5,8-DIEN-3-OL, (3.BETA.)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID801315054
Created by admin on Wed Apr 02 06:17:46 GMT 2025 , Edited by admin on Wed Apr 02 06:17:46 GMT 2025
PRIMARY
FDA UNII
R85BA49SYS
Created by admin on Wed Apr 02 06:17:46 GMT 2025 , Edited by admin on Wed Apr 02 06:17:46 GMT 2025
PRIMARY
CAS
70741-38-7
Created by admin on Wed Apr 02 06:17:46 GMT 2025 , Edited by admin on Wed Apr 02 06:17:46 GMT 2025
PRIMARY
PUBCHEM
129846
Created by admin on Wed Apr 02 06:17:46 GMT 2025 , Edited by admin on Wed Apr 02 06:17:46 GMT 2025
PRIMARY