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Details

Stereochemistry ACHIRAL
Molecular Formula 2C20H27O2.Zn
Molecular Weight 664.263
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 8
Charge 0

SHOW SMILES / InChI
Structure of TRETINOIN ZINC

SMILES

[Zn++].CC(\C=C\C1=C(C)CCCC1(C)C)=C/C=C/C(C)=C/C([O-])=O.CC(\C=C\C2=C(C)CCCC2(C)C)=C/C=C/C(C)=C/C([O-])=O

InChI

InChIKey=OYWXIJJKRYRHIN-DNOYCTHFSA-L
InChI=1S/2C20H28O2.Zn/c2*1-15(8-6-9-16(2)14-19(21)22)11-12-18-17(3)10-7-13-20(18,4)5;/h2*6,8-9,11-12,14H,7,10,13H2,1-5H3,(H,21,22);/q;;+2/p-2/b2*9-6+,12-11+,15-8+,16-14+;

HIDE SMILES / InChI

Molecular Formula Zn
Molecular Weight 65.409
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C20H27O2
Molecular Weight 299.4272
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 4
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 05:44:10 UTC 2023
Edited
by admin
on Sat Dec 16 05:44:10 UTC 2023
Record UNII
7A9179CU3G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TRETINOIN ZINC
Common Name English
RETINOIC ACID, ZINC SALT
Common Name English
Code System Code Type Description
FDA UNII
7A9179CU3G
Created by admin on Sat Dec 16 05:44:10 UTC 2023 , Edited by admin on Sat Dec 16 05:44:10 UTC 2023
PRIMARY
PUBCHEM
22013415
Created by admin on Sat Dec 16 05:44:10 UTC 2023 , Edited by admin on Sat Dec 16 05:44:10 UTC 2023
PRIMARY
EPA CompTox
DTXSID00226884
Created by admin on Sat Dec 16 05:44:10 UTC 2023 , Edited by admin on Sat Dec 16 05:44:10 UTC 2023
PRIMARY
CAS
75980-27-7
Created by admin on Sat Dec 16 05:44:10 UTC 2023 , Edited by admin on Sat Dec 16 05:44:10 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
PARENT -> SALT/SOLVATE
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ACTIVE MOIETY