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Ceftriaxone

CAT: 0013-GTR19220532-03Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19220532-03Size:50 mg
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Description
Ceftriaxone is a broad-spectrum cephalosporin antibiotic effective against numerous bacterial pathogens. Its utility in research extends to in vitro antimicrobial assays and in vivo infection models, where its secondary anti-inflammatory and antioxidant properties are also investigated.
CAS Number
73384-59-5
Product Name Alternative
Fungal
Field of Research
Cell Biology, Epigenetics & Chromatin, Infectious Disease & Virology, Pharmacology & Drug Discovery, Signal Transduction, Stem Cell & Developmental Biology
Purity
96.08% (May vary between batches)
Solubility
DMSO:137.5 mg/mL (247.94 mM)
Smiles
C (O) (=O) C=1N2[C@@] ([C@H] (NC (/C (=N\OC) /C3=CSC (N) =N3) =O) C2=O) (SCC1CSC=4N (C) NC (=O) C (=O) N4) [H]
Molecular Formula
C18H18N8O7S3
Molecular Weight
554.58
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Ceftriaxone

Ceftriaxone is a third-generation cephalosporin compound having 2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetylamino and [(2-methyl-5,6-dioxo-1,2,5,6-tetrahydro-1,2,4-triazin-3-yl)sulfanyl]methyl side-groups. It has a role as an EC 3.5.2.6 (beta-lactamase) inhibitor, an antibacterial drug and a drug allergen. It is a cephalosporin, an oxime O-ether, a member of 1,3-thiazoles and a member of 1,2,4-triazines. It is a conjugate acid of a ceftriaxone(1-).

CAS Number73384-59-5
PubChem CID5479530
IUPAC Name(6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[(2-methyl-5,6-dioxo-1H-1,2,4-triazin-3-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Molecular FormulaC18H18N8O7S3
Molecular Weight554.6
XLogP-1.3
Topological Polar Surface Area288
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count13
Rotatable Bond Count8
Heavy Atom Count36
Formal Charge0
Complexity1110
SMILES
CN1C(=NC(=O)C(=O)N1)SCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)/C(=N\OC)/C4=CSC(=N4)N)SC2)C(=O)O
InChI
InChI=1S/C18H18N8O7S3/c1-25-18(22-12(28)13(29)23-25)36-4-6-3-34-15-9(14(30)26(15)10(6)16(31)32)21-11(27)8(24-33-2)7-5-35-17(19)20-7/h5,9,15H,3-4H2,1-2H3,(H2,19,20)(H,21,27)(H,23,29)(H,31,32)/b24-8-/t9-,15-/m1/s1
InChIKey
VAAUVRVFOQPIGI-SPQHTLEESA-N
Chemical Structure
2D Structure
2D structure of Ceftriaxone
CAS: 73384-59-5
CID: 5479530
Formula: C18H18N8O7S3
MW: 554.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight554.6
XLogP3-1.3
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count13
Rotatable Bond Count8
Exact Mass554.04605846
Monoisotopic Mass554.04605846
Topological Polar Surface Area288 Ų
Heavy Atom Count36
Formal Charge0
Complexity1110
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

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T75295-01Ceftriaxone
RM-C062401-01Ceftriaxone EP Impurity A ((E) -Ceftriaxone)
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HY-B0712R-01Ceftriaxone (Standard)

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