Feedback

cephapirin(1-)

Properties

Image

Occurences in reactions

MNX_ID

MNXM727296

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

formula

C₁₇H₁₆N₃O₆S₂

charge

-1

mass

422.0486

reference

chebi:59217

InChIKey

UQLLWWBDSUHNEB-CZUORRHYSA-M

InChI

InChI=1S/C17H17N3O6S2/c1-9(21)26-6-10-7-28-16-13(15(23)20(16)14(10)17(24)25)19-12(22)8-27-11-2-4-18-5-3-11/h2-5,13,16H,6-8H2,1H3,(H,19,22)(H,24,25)/p-1/t13-,16-/m1/s1

SMILES

CC(=O)OCC1=C(C(=O)[O-])N2C(=O)[C@@H](NC(=O)CSc3ccncc3)[C@H]2SC1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:59217 chebi:59217	cephapirin(1-) (6R,7R)-3-(hydroxymethyl)-8-oxo-7-(2-(4-pyridylthio)acetamido)-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylate acetate (6R,7R)-3-[(acetyloxy)methyl]-8-oxo-7-{[(pyridin-4-ylsulfanyl)acetyl]amino}-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate 7-(pyrid-4-ylthioacetamido)cephalosporanate cephapirin anion
kegg.drug:D07636 keggD:D07636	Cefapirin (BAN) Cephapirin Metricure (TN)
sabiork.compound:9019 sabiorkM:9019 kegg.compound:C06896 keggC:C06896	Cephapirin
hmdb:HMDB0015270	Cephapirin (6R,7R)-3-(Acetoxymethyl)-8-oxo-7-{[(pyridin-4-ylsulfanyl)acetyl]amino}-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (6R,7R)-3-(Acetoxymethyl)-8-oxo-7-{[(pyridin-4-ylsulfanyl)acetyl]amino}-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (6R,7R)-3-(Acetoxymethyl)-8-oxo-7-{[(pyridin-4-ylsulphanyl)acetyl]amino}-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (6R,7R)-3-(Acetoxymethyl)-8-oxo-7-{[(pyridin-4-ylsulphanyl)acetyl]amino}-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (6R,7R)-3-[(acetyloxy)methyl]-8-oxo-7-[2-(pyridin-4-ylsulfanyl)acetamido]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Apothecon brand OF cephapirin sodium BL p 1322 BL-p 1322 Brisfirina Bristol-myers brand OF cephapirin sodium Bristol-myers squibb brand OF cephapirin sodium Céfaloject CEPR Cefadyl Cefapirin Cefapirina Cefapirine Cefapirinum Cefaprin Cephapirin monosodium salt Cephapirin sodium Cephapirin, sodium Cephapirine Metricure Monosodium salt, cephapirin Salt, cephapirin monosodium Sodium cephapirin
seed.compound:cpd04246 seedM:cpd04246	Cephapirin cephapirin
metacyc.compound:CPD0-2609 metacycM:CPD0-2609	cephapirin
CHEBI:554446 chebi:554446	cephapirin (6R,7R)-3-(acetoxymethyl)-8-oxo-7-{[(pyridin-4-ylsulfanyl)acetyl]amino}-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (6R,7R)-3-acetoxymethyl-7-[(pyridin-4-ylsulfanyl)acetamido]-3,4-didehydrocepham-4-carboxylic acid CEPR Cefaprin Cephapirine cefapirin cefapirina cefapirine cefapirinum
hmdb:HMDB0030451 hmdb:HMDB15270 hmdb:HMDB30451 chebi:3544 keggC:M_C06896 keggD:M_D07636 seedM:M_cpd04246	secondary/obsolete/fantasy identifier