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Details

Stereochemistry ABSOLUTE
Molecular Formula C12H18N2O5
Molecular Weight 270.2817
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BACILYSIN

SMILES

C[C@H](N)C(=O)N[C@@H](C[C@@H]1CCC(=O)[C@@H]2O[C@H]12)C(O)=O

InChI

InChIKey=XFOUAXMJRHNTOP-PFQXTLEHSA-N
InChI=1S/C12H18N2O5/c1-5(13)11(16)14-7(12(17)18)4-6-2-3-8(15)10-9(6)19-10/h5-7,9-10H,2-4,13H2,1H3,(H,14,16)(H,17,18)/t5-,6-,7-,9+,10-/m0/s1

HIDE SMILES / InChI

Molecular Formula C12H18N2O5
Molecular Weight 270.2817
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:21:34 GMT 2023
Edited
by admin
on Sat Dec 16 08:21:34 GMT 2023
Record UNII
90R5Q4BW17
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BACILYSIN
MI  
Common Name English
BACILYSIN [MI]
Common Name English
BACILLIN
Common Name English
ANTIBIOTIC KM-208
Code English
TETAINE
Brand Name English
L-ALANINE, L-ALANYL-3-((1R,2S,6R)-5-OXO-7-OXABICYCLO(4.1.0)HEPT-2-YL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
86583338
Created by admin on Sat Dec 16 08:21:34 GMT 2023 , Edited by admin on Sat Dec 16 08:21:34 GMT 2023
PRIMARY
CHEBI
84311
Created by admin on Sat Dec 16 08:21:34 GMT 2023 , Edited by admin on Sat Dec 16 08:21:34 GMT 2023
PRIMARY
CAS
29393-20-2
Created by admin on Sat Dec 16 08:21:34 GMT 2023 , Edited by admin on Sat Dec 16 08:21:34 GMT 2023
PRIMARY
EPA CompTox
DTXSID70183617
Created by admin on Sat Dec 16 08:21:34 GMT 2023 , Edited by admin on Sat Dec 16 08:21:34 GMT 2023
PRIMARY
CHEBI
72687
Created by admin on Sat Dec 16 08:21:34 GMT 2023 , Edited by admin on Sat Dec 16 08:21:34 GMT 2023
PRIMARY
FDA UNII
90R5Q4BW17
Created by admin on Sat Dec 16 08:21:34 GMT 2023 , Edited by admin on Sat Dec 16 08:21:34 GMT 2023
PRIMARY
MERCK INDEX
m2196
Created by admin on Sat Dec 16 08:21:34 GMT 2023 , Edited by admin on Sat Dec 16 08:21:34 GMT 2023
PRIMARY Merck Index
Related Record Type Details
ACTIVE MOIETY