Unii-upp5G59E4P

Basic Information

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CAS Number

878002-85-8

Molecular Formula

C51H56N12O14S6

Molecular Weight

1253.45 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

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C(C1=C(/C=C\C2SC=NC=2C)CS[C@@H]2[C@@H](C(N12)=O)NC(=O)/C(/C1=CSC(NCNC2SC=C(/C(=N/OC)/C(=O)N[C@@H]3C(=O)N4C(=C(CS[C@H]34)/C=C\C3SC=NC=3C)C(=O)OCOC(=O)C(C)(C)C)N=2)=N1)=N\OC)(=O)OCOC(=O)C(C)(C)C

InChI

1S/C51H56N12O14S6/c1-24-30(82-20-54-24)13-11-26-15-78-42-34(40(66)62(42)36(26)44(68)74-22-76-46(70)50(3,4)5)58-38(64)32(60-72-9)28-17-80-48(56-28)52-19-53-49-57-29(18-81-49)33(61-73-10)39(65)59-35-41(67)63-37(45(69)75-23-77-47(71)51(6,7)8)27(16-79-43(35)63)12-14-31-25(2)55-21-83-31/h11-14,17-18,20-21,34-35,42-43H,15-16,19,22-23H2,1-10H3,(H,52,56)(H,53,57)(H,58,64)(H,59,65)/b13-11-,14-12-,60-32-,61-33-/t34-,35-,42-,43-/m1/s1

InChIKey

DKCOGMPVRYSXGS-GRERCYAISA-N

Complexity

2540

Synonyms & References

English

UPP5G59E4P
Cefditoren dimer
Unii-upp5G59E4P
Cefditoren Pivoxil impurity P15
(2,2-Dimethyl-1-oxopropoxy)methyl (6R,7R)-7-[[(2Z)-2-[2-[[[[4-[(4Z)-2-[[(6R,7R)-2-[[(2,2-dimethyl-1-oxopropoxy)methoxy]carbonyl]-3-[(1Z)-2-(4-methyl-5-thiazolyl)ethenyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl]amino]-1-(methoxyimino)-2-oxoethyl]-2-thiazolyl]amino]methyl]amino]-4-thiazolyl]-2-(methoxyimino)acetyl]amino]-3-[(1Z)-2-(4-methyl-5-thiazolyl)ethenyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (ACI)
5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7,7′-[methylenebis[imino-2,4-thiazolediyl[(2Z)-2-(methoxyimino)-1-oxo-2,1-ethanediyl]imino]]bis[3-[(1Z)-2-(4-methyl-5-thiazolyl)ethenyl]-8-oxo-, bis[(2,2-dimethyl-1-oxopropoxy)methyl] ester, (6R,6′R,7R,7′R)- (9CI)
bis((pivaloyloxy)methyl) 7,7'-(((2Z,2'Z)-2,2'-((methylenebis(azanediyl)) bis(thiazole-2,4-diyl))bis(2-(methoxyimino)acetyl))bis(azanediyl)) (6R,6'R,7R,7'R)-bis(3-((Z)-2-(4-methylthiazol-5-yl)vinyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate)