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ACTIVE PHARMA INGREDIENTS

6 API Suppliers, 6 USDMF, $ API Reference Price

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$ API Reference Price

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Synopsis

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Chemistry

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Also known as: Chembl1235646, Q27465008, (2r)-2-[(r)-{[(6r)-6-amino-6-carboxyhexanoyl]amino}(carboxy)methyl]-5-methylidene-5,6-dihydro-2h-1,3-thiazine-4-carboxylic acid, Rec

Molecular Formula

C₁₅H₂₁N₃O₇S

Molecular Weight

387.4 g/mol

InChI Key

JGKXEMYIHDYWCZ-JFUSQASVSA-N

A group of broad-spectrum antibiotics first isolated from the Mediterranean fungus ACREMONIUM. They contain the beta-lactam moiety thia-azabicyclo-octenecarboxylic acid also called 7-aminocephalosporanic acid.

1 2D Structure

Cephalosporin

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(2R)-2-[(R)-[[(6R)-6-amino-6-carboxyhexanoyl]amino]-carboxymethyl]-5-methylidene-2H-1,3-thiazine-4-carboxylic acid

2.1.2 InChI

InChI=1S/C15H21N3O7S/c1-7-6-26-12(18-10(7)14(22)23)11(15(24)25)17-9(19)5-3-2-4-8(16)13(20)21/h8,11-12H,1-6,16H2,(H,17,19)(H,20,21)(H,22,23)(H,24,25)/t8-,11+,12-/m1/s1

2.1.3 InChI Key

JGKXEMYIHDYWCZ-JFUSQASVSA-N

2.1.4 Canonical SMILES

C=C1CSC(N=C1C(=O)O)C(C(=O)O)NC(=O)CCCCC(C(=O)O)N

2.1.5 Isomeric SMILES

C=C1CS[C@@H](N=C1C(=O)O)[C@@H](C(=O)O)NC(=O)CCCC[C@H](C(=O)O)N

2.2 Synonyms

2.2.1 MeSH Synonyms

1. Acid, Cephalosporanic

2. Acids, Cephalosporanic

3. Antibiotic, Cephalosporin

4. Antibiotics, Cephalosporin

5. Cephalosporanic Acid

6. Cephalosporanic Acids

7. Cephalosporin Antibiotic

8. Cephalosporin Antibiotics

9. Cephalosporins

2.2.2 Depositor-Supplied Synonyms

1. Chembl1235646

2. Q27465008

3. (2r)-2-[(r)-{[(6r)-6-amino-6-carboxyhexanoyl]amino}(carboxy)methyl]-5-methylidene-5,6-dihydro-2h-1,3-thiazine-4-carboxylic Acid

4. Rec

2.3 Create Date

2008-11-26

3 Chemical and Physical Properties

Molecular Formula	C₁₅H₂₁N₃O₇S
Molecular Weight	387.4 g/mol
XLogP3	-3.1
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	10
Exact Mass	387.11002119 g/mol
Monoisotopic Mass	387.11002119 g/mol
Topological Polar Surface Area	205 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	635
Isotope Atom Count	0
Defined Atom Stereocenter Count	3
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

4 Pharmacology and Biochemistry

4.1 MeSH Pharmacological Classification

Anti-Bacterial Agents

Substances that inhibit the growth or reproduction of BACTERIA. (See all compounds classified as Anti-Bacterial Agents.)

API SUPPLIERS

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USDMF

01

Astellas Pharma Inc

Japan

Medlab Asia & Asia Health

Not Confirmed

02

Fujisawa Pharmaceutical Co Ltd

Japan

Medlab Asia & Asia Health

Not Confirmed

03

Astellas Pharma Inc

Japan

Medlab Asia & Asia Health

Not Confirmed

04

Glaxo Wellcome Inc

United Kingdom

Medlab Asia & Asia Health

Not Confirmed

05

Glaxo Wellcome Inc

United Kingdom

Medlab Asia & Asia Health

Not Confirmed

06

Teva Pharmaceuticals Usa Inc

Israel

CPhI WW Frankfurt

Booth #6.1A32

FULL SCREEN VIEW Click here to open all results in a new tab [this preview display 10 results]

API Reference Price

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