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

Details

Stereochemistry ABSOLUTE
Molecular Formula C27H44O2
Molecular Weight 400.6371
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-OXOCHOLESTEROL

SMILES

[H][C@@]1(CC[C@@]2([H])[C@]3([H])C(=O)C=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCCC(C)C

InChI

InChIKey=YIKKMWSQVKJCOP-ABXCMAEBSA-N
InChI=1S/C27H44O2/c1-17(2)7-6-8-18(3)21-9-10-22-25-23(12-14-27(21,22)5)26(4)13-11-20(28)15-19(26)16-24(25)29/h16-18,20-23,25,28H,6-15H2,1-5H3/t18-,20+,21-,22+,23+,25+,26+,27-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
7-OXOCHOLESTEROL
Systematic Name English
7-KETOCHOLESTEROL
Systematic Name English
CHOLEST-5-EN-7-ONE, 3-.BETA.-HYDROXY-
Common Name English
Classification Tree Code System Code
LOINC 92764-0
Created by admin on Fri Dec 15 19:13:10 UTC 2023 , Edited by admin on Fri Dec 15 19:13:10 UTC 2023
Code System Code Type Description
FDA UNII
O7676FE78M
Created by admin on Fri Dec 15 19:13:10 UTC 2023 , Edited by admin on Fri Dec 15 19:13:10 UTC 2023
PRIMARY
CHEBI
64294
Created by admin on Fri Dec 15 19:13:10 UTC 2023 , Edited by admin on Fri Dec 15 19:13:10 UTC 2023
PRIMARY
MESH
C003001
Created by admin on Fri Dec 15 19:13:10 UTC 2023 , Edited by admin on Fri Dec 15 19:13:10 UTC 2023
PRIMARY
PUBCHEM
91474
Created by admin on Fri Dec 15 19:13:10 UTC 2023 , Edited by admin on Fri Dec 15 19:13:10 UTC 2023
PRIMARY
CAS
566-28-9
Created by admin on Fri Dec 15 19:13:10 UTC 2023 , Edited by admin on Fri Dec 15 19:13:10 UTC 2023
PRIMARY
EPA CompTox
DTXSID901033744
Created by admin on Fri Dec 15 19:13:10 UTC 2023 , Edited by admin on Fri Dec 15 19:13:10 UTC 2023
PRIMARY