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Substance Name: 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3,3'-(dithiobis(methylene))bis(7-(((2-amino-4-thiazolyl)(methoxyimino)acetyl)amino)-8-oxo-, (6R-(3(6R*,7R*(Z)),6alpha,7beta(Z)))-
RN: 120905-00-2
InChIKey: PYRWVZOVUOUHKK-AFQMBUBWSA-N

Molecular Formula

  • C28-H28-N10-O10-S6

Molecular Weight

  • 856.985
 
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Names and Synonyms

  • 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3,3'-(dithiobis(methylene))bis(7-(((2-amino-4-thiazolyl)(methoxyimino)acetyl)amino)-8-oxo-, (6R-(3(6R*,7R*(Z)),6alpha,7beta(Z)))-

Registry Numbers

CAS Registry Number

  • 120905-00-2

System Generated Number

  • 0120905002

Structure Descriptors

InChI

1S/C28H28N10O10S6/c1-47-35-13(11-7-51-27(29)31-11)19(39)33-15-21(41)37-17(25(43)44)9(3-49-23(15)37)5-53-54-6-10-4-50-24-16(22(42)38(24)18(10)26(45)46)34-20(40)14(36-48-2)12-8-52-28(30)32-12/h7-8,15-16,23-24H,3-6H2,1-2H3,(H2,29,31)(H2,30,32)(H,33,39)(H,34,40)(H,43,44)(H,45,46)/b35-13+,36-14+/t15-,16-,23-,24-/m1/s1

InChIKey

PYRWVZOVUOUHKK-AFQMBUBWSA-N

Smiles

S(SCC1=C(N2C([C@H]([C@H]2SC1)NC(=O)\C(=N\OC)c1nc(sc1)N)=O)C(=O)O)CC1=C(N2C([C@H]([C@H]2SC1)NC(=O)\C(=N\OC)c1nc(sc1)N)=O)C(=O)O