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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H38N4O15
Molecular Weight 622.5763
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Hexacarboxymethyl Dipeptide-12

SMILES

OC(=O)CN(CCCC[C@H](NC(=O)[C@H](CCCCN(CC(O)=O)CC(O)=O)N(CC(O)=O)CC(O)=O)C(O)=O)CC(O)=O

InChI

InChIKey=UTDVGKPREKYXHH-HOTGVXAUSA-N
InChI=1S/C24H38N4O15/c29-17(30)9-26(10-18(31)32)7-3-1-5-15(24(42)43)25-23(41)16(28(13-21(37)38)14-22(39)40)6-2-4-8-27(11-19(33)34)12-20(35)36/h15-16H,1-14H2,(H,25,41)(H,29,30)(H,31,32)(H,33,34)(H,35,36)(H,37,38)(H,39,40)(H,42,43)/t15-,16-/m0/s1

HIDE SMILES / InChI

Molecular Formula C24H38N4O15
Molecular Weight 622.5763
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 21:20:55 GMT 2025
Edited
by admin
on Wed Apr 02 21:20:55 GMT 2025
Record UNII
A5CR4WJQ6X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(2S)-2-[[(2S)-2,6-bis[bis(carboxymethyl)amino]hexanoyl]amino]-6-[bis(carboxymethyl)amino]hexanoic acid
Preferred Name English
Hexacarboxymethyl Dipeptide-12
INCI  
Official Name English
L-Lysine, N<sup>2</sup>,N<sup>2</sup>,N<sup>6</sup>,N<sup>6</sup>-tetrakis(carboxymethyl)-L-lysyl-N<sup>6</sup>,N<sup>6</sup>-bis(carboxymethyl)-
Systematic Name English
N<sup>2</sup>,N<sup>2</sup>,N<sup>6</sup>,N<sup>6</sup>-Tetrakis(carboxymethyl)-L-lysyl-N<sup>6</sup>,N<sup>6</sup>-bis(carboxymethyl)-L-lysine
Systematic Name English
Code System Code Type Description
PUBCHEM
134350025
Created by admin on Wed Apr 02 21:20:55 GMT 2025 , Edited by admin on Wed Apr 02 21:20:55 GMT 2025
PRIMARY
CAS
1894171-12-0
Created by admin on Wed Apr 02 21:20:55 GMT 2025 , Edited by admin on Wed Apr 02 21:20:55 GMT 2025
NON-SPECIFIC STEREOCHEMISTRY
CAS
1414380-75-8
Created by admin on Wed Apr 02 21:20:55 GMT 2025 , Edited by admin on Wed Apr 02 21:20:55 GMT 2025
PRIMARY
FDA UNII
A5CR4WJQ6X
Created by admin on Wed Apr 02 21:20:55 GMT 2025 , Edited by admin on Wed Apr 02 21:20:55 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT