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Details

Stereochemistry ACHIRAL
Molecular Formula 3C18H31O2.Fe
Molecular Weight 894.158
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 6
Charge 0

SHOW SMILES / InChI
Structure of FERRIC LINOLEATE

SMILES

[Fe+3].CCCCC\C=C/C\C=C/CCCCCCCC([O-])=O.CCCCC\C=C/C\C=C/CCCCCCCC([O-])=O.CCCCC\C=C/C\C=C/CCCCCCCC([O-])=O

InChI

InChIKey=AEJDTAYHARDWRW-VLKMOBIUSA-K
InChI=1S/3C18H32O2.Fe/c3*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;/h3*6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20);/q;;;+3/p-3/b3*7-6-,10-9-;

HIDE SMILES / InChI

Molecular Formula Fe
Molecular Weight 55.845
Charge 3
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C18H31O2
Molecular Weight 279.4375
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:04:22 GMT 2023
Edited
by admin
on Sat Dec 16 13:04:22 GMT 2023
Record UNII
XN14Q43F67
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FERRIC LINOLEATE
Common Name English
9,12-OCTADECADIENOIC ACID (Z,Z)-, IRON(3+) SALT
Systematic Name English
IRON(2+) DIOCTADECA-9,12-DIENOATE
Systematic Name English
9,12-OCTADECADIENOIC ACID (Z,Z)-, IRON SALT
Systematic Name English
IRON LINOLEATE
Systematic Name English
9,12-OCTADECADIENOIC ACID (9Z,12Z)-, IRON(3+) SALT (3:1)
Systematic Name English
IRON (9Z,12Z)-OCTADECA-9,12-DIENOATE
Systematic Name English
9,12-OCTADECADIENOIC ACID (9Z,12Z)-, IRON(3+) SALT
Systematic Name English
LINOLEIC ACID, IRON SALT
Systematic Name English
9,12-OCTADECADIENOIC ACID (9Z,12Z)-, IRON SALT
Systematic Name English
Code System Code Type Description
PUBCHEM
20842033
Created by admin on Sat Dec 16 13:04:22 GMT 2023 , Edited by admin on Sat Dec 16 13:04:22 GMT 2023
PRIMARY
EPA CompTox
DTXSID00998978
Created by admin on Sat Dec 16 13:04:22 GMT 2023 , Edited by admin on Sat Dec 16 13:04:22 GMT 2023
PRIMARY
ECHA (EC/EINECS)
231-930-7
Created by admin on Sat Dec 16 13:04:22 GMT 2023 , Edited by admin on Sat Dec 16 13:04:22 GMT 2023
PRIMARY
CAS
7779-63-7
Created by admin on Sat Dec 16 13:04:22 GMT 2023 , Edited by admin on Sat Dec 16 13:04:22 GMT 2023
NON-SPECIFIC STOICHIOMETRY
CAS
68109-59-1
Created by admin on Sat Dec 16 13:04:22 GMT 2023 , Edited by admin on Sat Dec 16 13:04:22 GMT 2023
PRIMARY
FDA UNII
XN14Q43F67
Created by admin on Sat Dec 16 13:04:22 GMT 2023 , Edited by admin on Sat Dec 16 13:04:22 GMT 2023
PRIMARY