Chemical identity

Cefalotin EP Impurity C / 7 Amino Cephalosporaranic Acid

CAS 957-68-6 · C10H12N2O5S

01Identity

Identifiers and names for this exact compound. Empty fields are left unassigned.

Lazychem IDLC-09700
PubChem CID441328
NameCefalotin EP Impurity C / 7 Amino Cephalosporaranic Acid
CAS RN957-68-6
Molecular formulaC10H12N2O5S
Molecular weight272.28 g/mol
IUPAC name(6R,7R)-3-[(Acetyloxy)methyl]-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
InChIKeyHSHGZXNAXBPPDL-HZGVNTEJSA-N

02Structure identifiers

2D structurePubChem CID 441328
2D structure: Cefalotin EP Impurity C / 7 Amino Cephalosporaranic Acid, CAS 957-68-6
Structure of Cefalotin EP Impurity C / 7 Amino Cephalosporaranic Acid (CAS 957-68-6). LazyChem record. Source identity: PubChem CID 441328. Confirm the identifiers before analytical use.Download structure image

Structure facts for this exact identity.

Molecular formulaC10H12N2O5S
InChIKeyHSHGZXNAXBPPDL-HZGVNTEJSA-N
Ring count2
Defined stereocentres2
Unassigned stereocentres0
SMILESCC(=O)OCC1=C(N2[C@@H]([C@@H](C2=O)N)SC1)C(=O)O
InChIInChI=1S/C10H12N2O5S/c1-4(13)17-2-5-3-18-9-6(11)8(14)12(9)7(5)10(15)16/h6,9H,2-3,11H2,1H3,(H,15,16)/t6-,9-/m1/s1

03Stereochemistry

The published structure contains 2 defined and 0 unassigned tetrahedral stereocentres. The exact wedge-and-dash depiction is shown above.

Defined stereocentres22D structure
Unassigned stereocentres02D structure
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 4Before symmetry reduction

Published same-connectivity configurations

2 records

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04India status for this compound

These results apply only to this exact compound name and CAS number. Confirm the current official instruments before making a regulatory decision.

NDPS / RCSNOT FOUND IN REVIEWED ENTRIESCAS 957-68-6 was not found in the reviewed exact-identity entries. Generic, class, analogue, salt and isomer provisions were not evaluated.
SCOMETNOT FOUND IN REVIEWED CAS ENTRIESCAS 957-68-6 was not found in the reviewed exact-CAS mapping. Generic and analogue entries were not evaluated.

05Names and relationships

Associated parent compound

Cefalotin; Cefoperazone

View associated product family

Other names

  • 7 Amino Cephalosporaranic Acid
  • Cefalotin EP Impurity C
  • 7-Aminocephalosporanic acid
  • 7-ACA
  • 7beta-Aminocephalosporanic acid
  • 7-Aminocephalosporinic acid
  • CHEBI:2255
  • (6R,7R)-3-(acetyloxymethyl)-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Related records from the same parent family

06Documented history

Dated discovery, occurrence, use and issue claims are published only when a suitable primary or government source is available.

No dated history available

No verified discovery, first report, occurrence, use or issue event is currently available for this identity.

07Sources