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Details

Stereochemistry ABSOLUTE
Molecular Formula C34H48Cl2O2
Molecular Weight 559.65
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CHOLESTERYL DICHLOROBENZOATE

SMILES

[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OC(=O)C5=CC=C(Cl)C=C5Cl)[C@H](C)CCCC(C)C

InChI

InChIKey=NZZFKZMKJPWVDL-XBGNAKIGSA-N
InChI=1S/C34H48Cl2O2/c1-21(2)7-6-8-22(3)28-13-14-29-26-11-9-23-19-25(38-32(37)27-12-10-24(35)20-31(27)36)15-17-33(23,4)30(26)16-18-34(28,29)5/h9-10,12,20-22,25-26,28-30H,6-8,11,13-19H2,1-5H3/t22-,25+,26+,28-,29+,30+,33+,34-/m1/s1

HIDE SMILES / InChI

Molecular Formula C34H48Cl2O2
Molecular Weight 559.65
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 Sat Dec 16 03:58:58 GMT 2023
Edited
by admin
on Sat Dec 16 03:58:58 GMT 2023
Record UNII
02YJ05O7O7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CHOLESTERYL DICHLOROBENZOATE
INCI  
INCI  
Official Name English
CHOLEST-5-EN-3.BETA.-YL 2,4-DICHLOROBENZOATE
Common Name English
CHOLEST-5-EN-3-OL (3.BETA.)-, 3-(2,4-DICHLOROBENZOATE)
Common Name English
CHOLEST-5-EN-3-OL (3.BETA.)-, 2,4-DICHLOROBENZOATE
Common Name English
CHOLESTERYL DICHLOROBENZOATE [INCI]
Common Name English
CHOLESTEROL, 2,4-DICHLOROBENZOATE
Common Name English
CHOLESTERYL 2,4-DICHLOROBENZOATE
Common Name English
Code System Code Type Description
PUBCHEM
7566714
Created by admin on Sat Dec 16 03:58:58 GMT 2023 , Edited by admin on Sat Dec 16 03:58:58 GMT 2023
PRIMARY
FDA UNII
02YJ05O7O7
Created by admin on Sat Dec 16 03:58:58 GMT 2023 , Edited by admin on Sat Dec 16 03:58:58 GMT 2023
PRIMARY
ECHA (EC/EINECS)
251-248-3
Created by admin on Sat Dec 16 03:58:58 GMT 2023 , Edited by admin on Sat Dec 16 03:58:58 GMT 2023
PRIMARY
EPA CompTox
DTXSID301014897
Created by admin on Sat Dec 16 03:58:58 GMT 2023 , Edited by admin on Sat Dec 16 03:58:58 GMT 2023
PRIMARY
CAS
32832-01-2
Created by admin on Sat Dec 16 03:58:58 GMT 2023 , Edited by admin on Sat Dec 16 03:58:58 GMT 2023
PRIMARY