(E)-Ceftriaxone

CAS
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CAS
92143-31-2
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Catalog Number

ACM92143312

Product Name

(E)-Ceftriaxone

Structure

Structure

CAS

92143-31-2

Category

Heterocyclic Organic Compound

Synonyms

(6R,7R)-7-[[(2E)-2-(2-Amino-4-thiazolyl)-2-(methoxyimino)acetyl]amino]-8-oxo-3-[[(1,2,5,6-tetrahydro-2-methyl-5,6-dioxo-1,2,4-triazin-3-yl)thio]methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic Acid; Ro 15-2254;

Molecular Weight

554.58

Molecular Formula

C₁₈H₁₈N₈O₇S₃

MSDS

COA

Spec Sheet

Download Spec Sheet

What is the molecular formula of (E)-Ceftriaxone?

The molecular formula of (E)-Ceftriaxone is C18H18N8O7S3.

What is the molecular weight of (E)-Ceftriaxone?

The molecular weight of (E)-Ceftriaxone is 554.6 g/mol.

What is the IUPAC name of (E)-Ceftriaxone?

The IUPAC name of (E)-Ceftriaxone is (6R,7R)-7-[[(2E)-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.

What is the InChI of (E)-Ceftriaxone?

The InChI of (E)-Ceftriaxone is 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.

What is the InChIKey of (E)-Ceftriaxone?

The InChIKey of (E)-Ceftriaxone is VAAUVRVFOQPIGI-TYHRLYECSA-N.

What is the canonical SMILES of (E)-Ceftriaxone?

The canonical SMILES of (E)-Ceftriaxone is CN1C(=NC(=O)C(=O)N1)SCC2=C(N3C(C(C3=O)NC(=O)C(=NOC)C4=CSC(=N4)N)SC2)C(=O)O.

What is the molecular weight of (E)-Ceftriaxone according to PubChem?

The molecular weight of (E)-Ceftriaxone according to PubChem is 554.6 g/mol.

What is the CAS number of (E)-Ceftriaxone?

The CAS number of (E)-Ceftriaxone is 73384-59-5.

What is the XLogP3 value of (E)-Ceftriaxone?

The XLogP3 value of (E)-Ceftriaxone is -1.3.

What is the hydrogen bond acceptor count of (E)-Ceftriaxone?

The hydrogen bond acceptor count of (E)-Ceftriaxone is 13.

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