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Details

Stereochemistry ABSOLUTE
Molecular Formula C56H79F3N2O3
Molecular Weight 885.2333
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CHOLESTERYL SIPONIMOD

SMILES

CCC1=C(CN2CC(C2)C(=O)O[C@H]3CC[C@]4(C)[C@H]5CC[C@]6(C)[C@H](CC[C@H]6[C@@H]5CC=C4C3)[C@H](C)CCCC(C)C)C=CC(=C1)C(\C)=N\OCC7=CC(=C(C=C7)C8CCCCC8)C(F)(F)F

InChI

InChIKey=UXKNUTNUOPQVRZ-XZJNQQAKSA-N
InChI=1S/C56H79F3N2O3/c1-8-40-30-42(38(5)60-63-35-39-17-21-47(41-15-10-9-11-16-41)52(29-39)56(57,58)59)18-19-43(40)32-61-33-44(34-61)53(62)64-46-25-27-54(6)45(31-46)20-22-48-50-24-23-49(37(4)14-12-13-36(2)3)55(50,7)28-26-51(48)54/h17-21,29-30,36-37,41,44,46,48-51H,8-16,22-28,31-35H2,1-7H3/b60-38+/t37-,46+,48+,49-,50+,51+,54+,55-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
CHOLESTEROL ESTER OF SIPONIMOD
Preferred Name English
CHOLESTERYL SIPONIMOD
Common Name English
SIPONIMOD METABOLITE M17
Common Name English
Code System Code Type Description
FDA UNII
K4GU1BTZ13
Created by admin on Wed Apr 02 04:09:59 GMT 2025 , Edited by admin on Wed Apr 02 04:09:59 GMT 2025
PRIMARY
PUBCHEM
155491262
Created by admin on Wed Apr 02 04:09:59 GMT 2025 , Edited by admin on Wed Apr 02 04:09:59 GMT 2025
PRIMARY PUBCHEM