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Details

Stereochemistry ABSOLUTE
Molecular Formula C11H12N6O5S
Molecular Weight 340.315
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CEFAZOLIN 3-HYDROXYMETHYL

SMILES

[H][C@]12SCC(CO)=C(N1C(=O)[C@H]2NC(=O)CN3C=NN=N3)C(O)=O

InChI

InChIKey=YGQTUWKIILQPEL-GMSGAONNSA-N
InChI=1S/C11H12N6O5S/c18-2-5-3-23-10-7(9(20)17(10)8(5)11(21)22)13-6(19)1-16-4-12-14-15-16/h4,7,10,18H,1-3H2,(H,13,19)(H,21,22)/t7-,10-/m1/s1

HIDE SMILES / InChI

Molecular Formula C11H12N6O5S
Molecular Weight 340.315
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:10:32 UTC 2023
Edited
by admin
on Sat Dec 16 11:10:32 UTC 2023
Record UNII
WK7TY2EQP9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CEFAZOLIN 3-HYDROXYMETHYL
Common Name English
5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 3-(HYDROXYMETHYL)-8-OXO-7-((2-(1H-TETRAZOL-1-YL)ACETYL)AMINO)-, (6R,7R)-
Systematic Name English
(6R,7R)-7-(2-(1H-TETRAZOL-1-YL)ACETAMIDO)-3-(HYDROXYMETHYL)-8-OXO-5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID
Systematic Name English
(6R,7R)-3-(HYDROXYMETHYL)-8-OXO-7-((2-(1H-TETRAZOL-1-YL)ACETYL)AMINO)-5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
CAS
478494-71-2
Created by admin on Sat Dec 16 11:10:32 UTC 2023 , Edited by admin on Sat Dec 16 11:10:32 UTC 2023
PRIMARY
FDA UNII
WK7TY2EQP9
Created by admin on Sat Dec 16 11:10:32 UTC 2023 , Edited by admin on Sat Dec 16 11:10:32 UTC 2023
PRIMARY
PUBCHEM
124584303
Created by admin on Sat Dec 16 11:10:32 UTC 2023 , Edited by admin on Sat Dec 16 11:10:32 UTC 2023
PRIMARY
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