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Cefiderocol

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Cefiderocol / CAS : 1225208-94-5

Appearance - UN -
HS - DG Class -
Synonyms (6R,7R)-7-[[(2Z)-2-(2-Amino-1,3-Thiazol-4-yl)-2-(2-Carboxypropan-2-Yloxyimino)Acetyl]Amino]-3-[[1-[2-[(2-Chloro-3,4-Dihydroxybenzoyl)Amino]Ethyl]Pyrrolidin-1-ium-1-yl]Methyl]-8-oxo-5-thia-1-Azabicyclo[4.2.0]oct-2-ene-2-Carboxylate; S-649266; RSC 649266
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Properties

Summary

Formula
C30H34ClN7O10S2
Molecular Mass
752.21500
Exact Mass
751.15000
PSA
310.44000
Logp
1.07800
IUPAC
(6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(2-carboxypropan-2-yloxyimino)acetyl]amino]-3-[[1-[2-[(2-chloro-3,4-dihydroxybenzoyl)amino]ethyl]pyrrolidin-1-ium-1-yl]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SMILES
CC(C)(C(=O)O)O/N=C(/C1=CSC(=N1)N)\C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)C[N+]4(CCCC4)CCNC(=O)C5=C(C(=C(C=C5)O)O)Cl)C(=O)[O-] InChIKey: DBPPRLRVDVJOCL-FQRUVTKNSA-N

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Antibiotics

Chemical and Physical Properties

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