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

Details

Stereochemistry RACEMIC
Molecular Formula C49H76O3
Molecular Weight 713.1259
Optical Activity ( + / - )
Defined Stereocenters 3 / 3
E/Z Centers 4
Charge 0

SHOW SMILES / InChI
Structure of TRETINOIN TOCOFERIL

SMILES

CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@]1(C)CCC2=C(O1)C(C)=C(C)C(OC(=O)\C=C(C)\C=C\C=C(C)\C=C\C3=C(C)CCCC3(C)C)=C2C

InChI

InChIKey=RIQIJXOWVAHQES-UNAKLNRMSA-N
InChI=1S/C49H76O3/c1-34(2)19-14-20-35(3)21-15-22-36(4)25-17-31-49(13)32-29-43-42(10)46(40(8)41(9)47(43)52-49)51-45(50)33-38(6)24-16-23-37(5)27-28-44-39(7)26-18-30-48(44,11)12/h16,23-24,27-28,33-36H,14-15,17-22,25-26,29-32H2,1-13H3/b24-16+,28-27+,37-23+,38-33+/t35-,36-,49-/m1/s1

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
TRETINOIN TOCOFERIL
INN   JAN   WHO-DD  
INN  
Official Name English
TRETINOIN TOCOFERIL [JAN]
Common Name English
RETINOIC ACID .ALPHA.-TOCOPHERYL ESTER [MI]
Common Name English
TOCORETINATE [MI]
Common Name English
N-021
Code English
Tretinoin tocoferil [WHO-DD]
Common Name English
L-300
Code English
(±)-(2R*)-2,5,7,8-TETRAMETHYL-2-((4R*,8R*)-4,8,12-TRIMETHYLTRIDECYL)-6-CHROMANYL RETINOATE
Common Name English
N021
Code English
TOCORETINATE
MI  
Common Name English
L300
Code English
TOCORETINATE [JAN]
Common Name English
RETINOIC ACID, (2R)-3,4-DIHYDRO-2,5,7,8-TETRAMETHYL-2-((4R,8R)-4,8,12-TRIMETHYLTRIDECYL)-2H-1-BENZOPYRAN-6-YL ESTER, (±)-
Systematic Name English
tretinoin tocoferil [INN]
Common Name English
RETINOIC ACID, 3,4-DIHYDRO-2,5,7,8-TETRAMETHYL-2-(4,8,12-TRIMETHYLTRIDECYL)-2H-1-BENZOPYRAN-6-YL ESTER, (2R*(4R*,8R*))-(±)-
Common Name English
OLCENON
Brand Name English
Classification Tree Code System Code
NCI_THESAURUS C1934
Created by admin on Sat Dec 16 17:56:15 GMT 2023 , Edited by admin on Sat Dec 16 17:56:15 GMT 2023
Code System Code Type Description
EPA CompTox
DTXSID6046923
Created by admin on Sat Dec 16 17:56:15 GMT 2023 , Edited by admin on Sat Dec 16 17:56:15 GMT 2023
PRIMARY
MERCK INDEX
m9558
Created by admin on Sat Dec 16 17:56:15 GMT 2023 , Edited by admin on Sat Dec 16 17:56:15 GMT 2023
PRIMARY
NCI_THESAURUS
C66628
Created by admin on Sat Dec 16 17:56:15 GMT 2023 , Edited by admin on Sat Dec 16 17:56:15 GMT 2023
PRIMARY
MESH
C089853
Created by admin on Sat Dec 16 17:56:15 GMT 2023 , Edited by admin on Sat Dec 16 17:56:15 GMT 2023
PRIMARY
SMS_ID
100000077488
Created by admin on Sat Dec 16 17:56:15 GMT 2023 , Edited by admin on Sat Dec 16 17:56:15 GMT 2023
PRIMARY
EVMPD
SUB11247MIG
Created by admin on Sat Dec 16 17:56:15 GMT 2023 , Edited by admin on Sat Dec 16 17:56:15 GMT 2023
PRIMARY
PUBCHEM
5282180
Created by admin on Sat Dec 16 17:56:15 GMT 2023 , Edited by admin on Sat Dec 16 17:56:15 GMT 2023
PRIMARY
CAS
40516-48-1
Created by admin on Sat Dec 16 17:56:15 GMT 2023 , Edited by admin on Sat Dec 16 17:56:15 GMT 2023
PRIMARY
FDA UNII
CTD060B1SS
Created by admin on Sat Dec 16 17:56:15 GMT 2023 , Edited by admin on Sat Dec 16 17:56:15 GMT 2023
PRIMARY
INN
6847
Created by admin on Sat Dec 16 17:56:15 GMT 2023 , Edited by admin on Sat Dec 16 17:56:15 GMT 2023
PRIMARY
ChEMBL
CHEMBL2218871
Created by admin on Sat Dec 16 17:56:15 GMT 2023 , Edited by admin on Sat Dec 16 17:56:15 GMT 2023
PRIMARY
DRUG CENTRAL
2721
Created by admin on Sat Dec 16 17:56:15 GMT 2023 , Edited by admin on Sat Dec 16 17:56:15 GMT 2023
PRIMARY
MERCK INDEX
m10927
Created by admin on Sat Dec 16 17:56:15 GMT 2023 , Edited by admin on Sat Dec 16 17:56:15 GMT 2023
PRIMARY Merck Index
ACTIVE MOIETY
Structure of TRETINOIN
SUBSTANCE RECORD
Structure of TRETINOIN TOCOFERIL
NIH
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