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Details

Stereochemistry ACHIRAL
Molecular Formula C20H37O2.Na
Molecular Weight 332.4963
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of SODIUM GADOLEATE

SMILES

[Na+].CCCCCCCCCC\C=C/CCCCCCCC([O-])=O

InChI

InChIKey=SCEFIDHNJSJIHH-AFEZEDKISA-M
InChI=1S/C20H38O2.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22;/h11-12H,2-10,13-19H2,1H3,(H,21,22);/q;+1/p-1/b12-11-;

HIDE SMILES / InChI

Molecular Formula C20H37O2
Molecular Weight 309.5066
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:01:20 GMT 2023
Edited
by admin
on Fri Dec 15 16:01:20 GMT 2023
Record UNII
8M79NYO9LD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM GADOLEATE
Systematic Name English
CIS-9-EICOSENOIC ACID, SODIUM SALT
Common Name English
9-EICOSENOIC ACID, SODIUM SALT, (9Z)-
Common Name English
Code System Code Type Description
PUBCHEM
76972179
Created by admin on Fri Dec 15 16:01:20 GMT 2023 , Edited by admin on Fri Dec 15 16:01:20 GMT 2023
PRIMARY
ECHA (EC/EINECS)
302-930-5
Created by admin on Fri Dec 15 16:01:20 GMT 2023 , Edited by admin on Fri Dec 15 16:01:20 GMT 2023
PRIMARY
CAS
94135-60-1
Created by admin on Fri Dec 15 16:01:20 GMT 2023 , Edited by admin on Fri Dec 15 16:01:20 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
FDA UNII
8M79NYO9LD
Created by admin on Fri Dec 15 16:01:20 GMT 2023 , Edited by admin on Fri Dec 15 16:01:20 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE