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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H22N6O5S
Molecular Weight 434.469
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BLP-1654

SMILES

[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)[C@H](NC(=O)NC(N)=N)C3=CC=CC=C3)C(O)=O

InChI

InChIKey=GIPLLNWRTXVAHM-NJBDSQKTSA-N
InChI=1S/C18H22N6O5S/c1-18(2)11(15(27)28)24-13(26)10(14(24)30-18)21-12(25)9(8-6-4-3-5-7-8)22-17(29)23-16(19)20/h3-7,9-11,14H,1-2H3,(H,21,25)(H,27,28)(H5,19,20,22,23,29)/t9-,10-,11+,14-/m1/s1

HIDE SMILES / InChI

Molecular Formula C18H22N6O5S
Molecular Weight 434.469
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 16:19:20 GMT 2023
Edited
by admin
on Sat Dec 16 16:19:20 GMT 2023
Record UNII
0BL51C9681
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BLP-1654
Common Name English
BLP 1654
Common Name English
4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID, 6-(((2R)-((((AMINOIMINOMETHYL)AMINO)CARBONYL)AMINO)PHENYLACETYL)AMINO)-3,3-DIMETHYL-7-OXO-, (2S,5R,6R)-
Systematic Name English
4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID, 6-((((((AMINOIMINOMETHYL)AMINO)CARBONYL)AMINO)PHENYLACETYL)AMINO)-3,3-DIMETHYL-7-OXO-, (2S-(2.ALPHA.,5.ALPHA.,6.BETA.(S*)))- 6-(D-.ALPHA.-(3-GUANYLUREIDO)PHENYLACETAMIDO)PENICILLANIC ACID
Systematic Name English
BL-P 1654
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID00951523
Created by admin on Sat Dec 16 16:19:20 GMT 2023 , Edited by admin on Sat Dec 16 16:19:20 GMT 2023
PRIMARY
PUBCHEM
127258018
Created by admin on Sat Dec 16 16:19:20 GMT 2023 , Edited by admin on Sat Dec 16 16:19:20 GMT 2023
PRIMARY
FDA UNII
0BL51C9681
Created by admin on Sat Dec 16 16:19:20 GMT 2023 , Edited by admin on Sat Dec 16 16:19:20 GMT 2023
PRIMARY
CAS
28889-87-4
Created by admin on Sat Dec 16 16:19:20 GMT 2023 , Edited by admin on Sat Dec 16 16:19:20 GMT 2023
PRIMARY
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