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Details

Stereochemistry ABSOLUTE
Molecular Formula C32H48N6O12S
Molecular Weight 740.822
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LYSYL BARZUXETAN

SMILES

N[C@@H](CCCCNC(=S)NC1=CC=C(C[C@H](CN(CC(O)=O)[C@H]2CCCC[C@@H]2N(CC(O)=O)CC(O)=O)N(CC(O)=O)CC(O)=O)C=C1)C(O)=O

InChI

InChIKey=VXHPSHQIVRWGIQ-ROHNOIKCSA-N
InChI=1S/C32H48N6O12S/c33-23(31(49)50)5-3-4-12-34-32(51)35-21-10-8-20(9-11-21)13-22(36(15-26(39)40)16-27(41)42)14-37(17-28(43)44)24-6-1-2-7-25(24)38(18-29(45)46)19-30(47)48/h8-11,22-25H,1-7,12-19,33H2,(H,39,40)(H,41,42)(H,43,44)(H,45,46)(H,47,48)(H,49,50)(H2,34,35,51)/t22-,23+,24+,25+/m1/s1

HIDE SMILES / InChI

Molecular Formula C32H48N6O12S
Molecular Weight 740.822
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:20:25 GMT 2023
Edited
by admin
on Sat Dec 16 14:20:25 GMT 2023
Record UNII
ST0A53I7XP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LYSYL BARZUXETAN
Common Name English
(2S)-2-AMINO-6-((4-((2R)-2-(BIS(CARBOXYMETHYL)AMINO)-3-(((1S,2S)-2-(BIS(CARBOXYMETHYL)AMINO)CYCLOHEXYL)-(CARBOXYMETHYL)AMINO)PROPYL)PHENYL)CARBAMOTHIOYLAMINO)HEXANOIC ACID
Systematic Name English
Code System Code Type Description
PUBCHEM
134694290
Created by admin on Sat Dec 16 14:20:25 GMT 2023 , Edited by admin on Sat Dec 16 14:20:25 GMT 2023
PRIMARY
FDA UNII
ST0A53I7XP
Created by admin on Sat Dec 16 14:20:25 GMT 2023 , Edited by admin on Sat Dec 16 14:20:25 GMT 2023
PRIMARY
Related Record Type Details
CONJUGATE->CONJUGATE COMPONENT