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Substance Name: CM 40876
RN: 116763-49-6
InChIKey: HCCFUFNFJIUPHS-UMIMETMPSA-N

Molecular Weight

  • 608.6746
 
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Names and Synonyms

Name of Substance

  • CM 40876

Synonym

  • CM-40876

Systematic Name

  • Pyridinium, 4-(((7-(((2-amino-4-thiazolyl)((1-carboxy-1-methylethoxy)imino)acetyl)amino)-2-carboxy-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-en-3-yl)methyl)thio)-1-methyl-, hydroxide, inner salt, S-oxide, (6R-(6alpha,7beta(Z)))-

Registry Numbers

CAS Registry Number

  • 116763-49-6

System Generated Number

  • 0116763496

Structure Descriptors

InChI

1S/C23H24N6O8S3/c1-23(2,21(34)35)37-27-14(13-9-39-22(24)25-13)17(30)26-15-18(31)29-16(20(32)33)11(10-40(36)19(15)29)8-38-12-4-6-28(3)7-5-12/h4-7,9,15,19H,8,10H2,1-3H3,(H4-,24,25,26,30,32,33,34,35)/b27-14+/t15-,19-,40?/m0/s1

InChIKey

HCCFUFNFJIUPHS-UMIMETMPSA-N

Smiles

C[n+]1ccc(SCC2=C(N3[C@H]([C@@H](NC(=O)\C(=N\OC(C)(C)C(=O)[O-])\c4csc(N)n4)C3=O)S(=O)C2)C(=O)O)cc1