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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H32N4O6S
Molecular Weight 480.578
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENZYLPENICILLOYL-.EPSILON.-L-LYSINE

SMILES

[H][C@]1(N[C@@H](C(O)=O)C(C)(C)S1)[C@H](NC(=O)CC2=CC=CC=C2)C(=O)NCCCC[C@H](N)C(O)=O

InChI

InChIKey=WJEDAXQWYZLHII-LKCYJCQHSA-N
InChI=1S/C22H32N4O6S/c1-22(2)17(21(31)32)26-19(33-22)16(25-15(27)12-13-8-4-3-5-9-13)18(28)24-11-7-6-10-14(23)20(29)30/h3-5,8-9,14,16-17,19,26H,6-7,10-12,23H2,1-2H3,(H,24,28)(H,25,27)(H,29,30)(H,31,32)/t14-,16+,17-,19+/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H32N4O6S
Molecular Weight 480.578
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 13:27:21 GMT 2023
Edited
by admin
on Sat Dec 16 13:27:21 GMT 2023
Record UNII
G4MW54QH9R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZYLPENICILLOYL-.EPSILON.-L-LYSINE
Common Name English
LYSINE, N6-((4S-CARBOXY-5,5-DIMETHYL-2R-THIAZOLIDINYL)(2R-PHENYLACETAMIDO)ACETYL)-, L-
Systematic Name English
Code System Code Type Description
FDA UNII
G4MW54QH9R
Created by admin on Sat Dec 16 13:27:21 GMT 2023 , Edited by admin on Sat Dec 16 13:27:21 GMT 2023
PRIMARY
CAS
25616-15-3
Created by admin on Sat Dec 16 13:27:21 GMT 2023 , Edited by admin on Sat Dec 16 13:27:21 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
PUBCHEM
124081804
Created by admin on Sat Dec 16 13:27:21 GMT 2023 , Edited by admin on Sat Dec 16 13:27:21 GMT 2023
PRIMARY
EPA CompTox
DTXSID001116531
Created by admin on Sat Dec 16 13:27:21 GMT 2023 , Edited by admin on Sat Dec 16 13:27:21 GMT 2023
PRIMARY