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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H44N4O13
Molecular Weight 620.6466
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 1
Charge 0
Stereo Comments Assumed Z-isomer

SHOW SMILES / InChI
Structure of CDM-NAG-LYSINE 2

SMILES

CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1OCCOCCNC(=O)CC\C(C(=O)NCCCC[C@H](N)C(O)=O)=C(/C)C(O)=O

InChI

InChIKey=GEJUAYLRCZMSGQ-WJWZPUDHSA-N
InChI=1S/C26H44N4O13/c1-14(24(37)38)16(23(36)29-8-4-3-5-17(27)25(39)40)6-7-19(33)28-9-10-41-11-12-42-26-20(30-15(2)32)22(35)21(34)18(13-31)43-26/h17-18,20-22,26,31,34-35H,3-13,27H2,1-2H3,(H,28,33)(H,29,36)(H,30,32)(H,37,38)(H,39,40)/b16-14-/t17-,18+,20+,21-,22+,26+/m0/s1

HIDE SMILES / InChI

Molecular Formula C26H44N4O13
Molecular Weight 620.6466
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:15:04 GMT 2023
Edited
by admin
on Sat Dec 16 15:15:04 GMT 2023
Record UNII
F68ES07O71
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CDM-NAG-LYSINE 2
Common Name English
Code System Code Type Description
FDA UNII
F68ES07O71
Created by admin on Sat Dec 16 15:15:04 GMT 2023 , Edited by admin on Sat Dec 16 15:15:04 GMT 2023
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PUBCHEM
138394048
Created by admin on Sat Dec 16 15:15:04 GMT 2023 , Edited by admin on Sat Dec 16 15:15:04 GMT 2023
PRIMARY