(Q76393585)

English

(6R,7R)-7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyiminoacetyl]amino]-8-oxo-3-(2H-triazol-4-ylsulfanylmethylsulfanyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

chemical compound

(E)-cefmatilen

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instance of

type of chemical entity

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subclass of

chemical compound

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mass

513.9969995480001 dalton

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based on heuristic

inferred from isomeric SMILES

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C₁₅H₁₄N₈O₅S₄

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canonical SMILES

O=C(O)C1=C(SCSC2=CN=NN2)CSC3N1C(=O)C3NC(=O)C(=NO)C=4N=C(SC4)N

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isomeric SMILES

C1C(=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)/C(=N/O)/C3=CSC(=N3)N)C(=O)O)SCSC4=NNN=C4

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Identifiers

InChI

InChI=1S/C15H14N8O5S4/c16-15-18-5(2-30-15)8(21-28)11(24)19-9-12(25)23-10(14(26)27)6(3-29-13(9)23)31-4-32-7-1-17-22-20-7/h1-2,9,13,28H,3-4H2,(H2,16,18)(H,19,24)(H,26,27)(H,17,20,22)/b21-8+/t9-,13-/m1/s1

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InChIKey

UEQVTKSAEXANEZ-DKQCJYJNSA-N

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Guide to Pharmacology Ligand ID

10778

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stated in

IUPHAR/BPS Guide to PHARMACOLOGY

retrieved

5 February 2021

Probes And Drugs ID

PD131864

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(Q76393585)

(6R,7R)-7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyiminoacetyl]amino]-8-oxo-3-(2H-triazol-4-ylsulfanylmethylsulfanyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

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