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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H45IO
Molecular Weight 512.5501
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IODOCHOLESTEROL

SMILES

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

InChI

InChIKey=FIOAEFCJGZJUPW-FTLVODPJSA-N
InChI=1S/C27H45IO/c1-18(2)6-5-7-19(3)23-10-11-24-22-9-8-20-16-21(29)12-15-27(20,17-28)25(22)13-14-26(23,24)4/h8,18-19,21-25,29H,5-7,9-17H2,1-4H3/t19-,21+,22+,23-,24+,25+,26-,27-/m1/s1

HIDE SMILES / InChI

Molecular Formula C27H45IO
Molecular Weight 512.5501
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:22:54 GMT 2023
Edited
by admin
on Fri Dec 15 15:22:54 GMT 2023
Record UNII
4A4E6EXB6U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IODOCHOLESTEROL
Systematic Name English
CHOLEST-5-EN-3-OL, 19-IODO-, (3.BETA.)-
Systematic Name English
19-IODOCHOLESTEROL
Systematic Name English
Code System Code Type Description
CAS
37414-03-2
Created by admin on Fri Dec 15 15:22:54 GMT 2023 , Edited by admin on Fri Dec 15 15:22:54 GMT 2023
PRIMARY
EPA CompTox
DTXSID80190857
Created by admin on Fri Dec 15 15:22:54 GMT 2023 , Edited by admin on Fri Dec 15 15:22:54 GMT 2023
PRIMARY
ECHA (EC/EINECS)
253-499-4
Created by admin on Fri Dec 15 15:22:54 GMT 2023 , Edited by admin on Fri Dec 15 15:22:54 GMT 2023
PRIMARY
PUBCHEM
21150757
Created by admin on Fri Dec 15 15:22:54 GMT 2023 , Edited by admin on Fri Dec 15 15:22:54 GMT 2023
PRIMARY
WIKIPEDIA
19-IODOCHOLESTEROL
Created by admin on Fri Dec 15 15:22:54 GMT 2023 , Edited by admin on Fri Dec 15 15:22:54 GMT 2023
PRIMARY
FDA UNII
4A4E6EXB6U
Created by admin on Fri Dec 15 15:22:54 GMT 2023 , Edited by admin on Fri Dec 15 15:22:54 GMT 2023
PRIMARY