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Details

Stereochemistry EPIMERIC
Molecular Formula C66H110N12O25S
Molecular Weight 1503.71
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LYSYL PEG AZETIDINONE LINKER LYSINE

SMILES

N[C@@H](CCCCNC(=O)CCNC(=O)CCC1=CC=C(NC(=O)COCC(=O)N[C@@H](CSC2CC(=O)N(CCC(=O)NCCOCCOCCOCCOCCC(=O)NCCCC[C@H](N)C(O)=O)C2=O)C(=O)NCCOCCOCCOCCOCCC(=O)NCCCC[C@H](N)C(O)=O)C=C1)C(O)=O

InChI

InChIKey=HZXAIWJZECSBSO-MGDZDZHSSA-N
InChI=1S/C66H110N12O25S/c67-49(64(89)90)7-1-4-20-70-55(80)16-23-73-54(79)15-12-47-10-13-48(14-11-47)76-59(84)44-103-45-60(85)77-52(62(87)75-25-30-98-34-38-102-42-40-100-36-32-96-28-19-58(83)72-22-6-3-9-51(69)66(93)94)46-104-53-43-61(86)78(63(53)88)26-17-56(81)74-24-29-97-33-37-101-41-39-99-35-31-95-27-18-57(82)71-21-5-2-8-50(68)65(91)92/h10-11,13-14,49-53H,1-9,12,15-46,67-69H2,(H,70,80)(H,71,82)(H,72,83)(H,73,79)(H,74,81)(H,75,87)(H,76,84)(H,77,85)(H,89,90)(H,91,92)(H,93,94)/t49-,50-,51-,52-,53?/m0/s1

HIDE SMILES / InChI

Molecular Formula C66H110N12O25S
Molecular Weight 1503.71
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 4 / 5
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:18:09 GMT 2023
Edited
by admin
on Sat Dec 16 15:18:09 GMT 2023
Record UNII
VKX8V94O0G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LYSYL PEG AZETIDINONE LINKER LYSINE
Common Name English
Code System Code Type Description
FDA UNII
VKX8V94O0G
Created by admin on Sat Dec 16 15:18:09 GMT 2023 , Edited by admin on Sat Dec 16 15:18:09 GMT 2023
PRIMARY
PUBCHEM
165412018
Created by admin on Sat Dec 16 15:18:09 GMT 2023 , Edited by admin on Sat Dec 16 15:18:09 GMT 2023
PRIMARY
Related Record Type Details
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