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Details

Stereochemistry ABSOLUTE
Molecular Formula C29H43NO2S
Molecular Weight 469.722
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of EFLUCIMIBE

SMILES

CCCCCCCCCCCCS[C@H](C(=O)NC1=CC(C)=C(O)C(C)=C1C)C2=CC=CC=C2

InChI

InChIKey=ZXEIEKDGPVTZLD-NDEPHWFRSA-N
InChI=1S/C29H43NO2S/c1-5-6-7-8-9-10-11-12-13-17-20-33-28(25-18-15-14-16-19-25)29(32)30-26-21-22(2)27(31)24(4)23(26)3/h14-16,18-19,21,28,31H,5-13,17,20H2,1-4H3,(H,30,32)/t28-/m0/s1

HIDE SMILES / InChI

Molecular Formula C29H43NO2S
Molecular Weight 469.722
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:06:09 UTC 2023
Edited
by admin
on Fri Dec 15 16:06:09 UTC 2023
Record UNII
3DK1X2C37M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
EFLUCIMIBE
INN  
INN  
Official Name English
F-12511
Code English
(S)-2-(DODECYLTHIO)-4'-HYDROXY-2',3',5'-TRIMETHYL-2-PHENYLACETANILIDE
Systematic Name English
eflucimibe [INN]
Common Name English
(S)-2',3',5'-TRIMETHYL-4'-HYDROXY-.ALPHA.-DODECYLTHIOACETANILIDE
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29703
Created by admin on Fri Dec 15 16:06:09 UTC 2023 , Edited by admin on Fri Dec 15 16:06:09 UTC 2023
Code System Code Type Description
PUBCHEM
9804740
Created by admin on Fri Dec 15 16:06:09 UTC 2023 , Edited by admin on Fri Dec 15 16:06:09 UTC 2023
PRIMARY
FDA UNII
3DK1X2C37M
Created by admin on Fri Dec 15 16:06:09 UTC 2023 , Edited by admin on Fri Dec 15 16:06:09 UTC 2023
PRIMARY
INN
7802
Created by admin on Fri Dec 15 16:06:09 UTC 2023 , Edited by admin on Fri Dec 15 16:06:09 UTC 2023
PRIMARY
EPA CompTox
DTXSID70174085
Created by admin on Fri Dec 15 16:06:09 UTC 2023 , Edited by admin on Fri Dec 15 16:06:09 UTC 2023
PRIMARY
NCI_THESAURUS
C75995
Created by admin on Fri Dec 15 16:06:09 UTC 2023 , Edited by admin on Fri Dec 15 16:06:09 UTC 2023
PRIMARY
ChEMBL
CHEMBL1908306
Created by admin on Fri Dec 15 16:06:09 UTC 2023 , Edited by admin on Fri Dec 15 16:06:09 UTC 2023
PRIMARY
CAS
202340-45-2
Created by admin on Fri Dec 15 16:06:09 UTC 2023 , Edited by admin on Fri Dec 15 16:06:09 UTC 2023
PRIMARY
SMS_ID
300000034238
Created by admin on Fri Dec 15 16:06:09 UTC 2023 , Edited by admin on Fri Dec 15 16:06:09 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY