Quinacillin

Catalog Number

ACM1596630

Product Name

Quinacillin

Structure

CAS

1596-63-0

Category

Heterocyclic Organic Compound

Synonyms

Quinacillin, Quinacillinum, Quinacilina, Quinacilline, Quinacilina [INN-Spanish], Quinacilline [INN-French], Quinacillinum [INN-Latin], UNII-83NB50X92M, CID92894, EINECS 216-481-7, (3-Carboxy-2-quinoxalinyl)penicillin, 3-Carboxy-2-quinoxalinylpenicillanic acid, (2S,5R,6R)-6-(3-Carboxy-2-chinoxalinylcarboxamido)-3,3-dimethyl-7-oxo-4-thia-azabicyclo(3.2.0)heptan-2-carbonsaeure, 1596-63-0, 6-(3-Carboxy-2-chinoxalinecarboxamido)-3,3-dimethyl-7-oxo-4-thia-azabicyclo(3.2.0)heptan-2-carbonsaeure, 6-(3-Carboxy-2-quinoxalinecarboxamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid

IUPAC Name

(2S,5R,6R)-6-[(3-carboxyquinoxaline-2-carbonyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Molecular Weight

416.408 g/mol

Molecular Formula

C₁₈H₁₆N₄O₆S

Canonical SMILES

CC1(C(N2C(S1)C(C2=O)NC(=O)C3=NC4=CC=CC=C4N=C3C(=O)O)C(=O)O)C

InChI Key

GPMSLJIYNWBYEL-TYNCELHUSA-N

Boiling Point

781.4ºC at 760mmHg

Flash Point

426.4ºC

Density

1.68g/cm³

EC Number

216-481-7

Exact Mass

416.07900

H-Bond Acceptor

8

H-Bond Donor

3

MSDS

COA

Spec Sheet