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Details

Stereochemistry ACHIRAL
Molecular Formula 2C20H27O2.Zn
Molecular Weight 664.263
Optical Activity UNSPECIFIED
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
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
Defined Stereocenters 0 / 0
E/Z Centers 4
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Oct 22 13:55:55 UTC 2019
Edited
by admin
on Tue Oct 22 13:55:55 UTC 2019
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
PUBCHEM
22013415
Created by admin on Tue Oct 22 13:55:55 UTC 2019 , Edited by admin on Tue Oct 22 13:55:55 UTC 2019
PRIMARY
EPA CompTox
75980-27-7
Created by admin on Tue Oct 22 13:55:55 UTC 2019 , Edited by admin on Tue Oct 22 13:55:55 UTC 2019
PRIMARY
CAS
75980-27-7
Created by admin on Tue Oct 22 13:55:55 UTC 2019 , Edited by admin on Tue Oct 22 13:55:55 UTC 2019
PRIMARY
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PARENT -> SALT/SOLVATE
PARENT -> SALT/SOLVATE
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ACTIVE MOIETY