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Substance Name: Ro 25-0534
RN: 143488-32-8
InChIKey: IXDFVVUXTFRFQQ-MOSWNVLFSA-N

Note

  • An antipseudomonal dual-action drug; a tertiary amine-linked combination of a catechol cephalosporin and ciprofloxacin.

Molecular Weight

  • 948.963
 
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Names and Synonyms

Name of Substance

  • Ro 25-0534

Synonym

  • Ro-25-0534

Systematic Name

  • 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((2Z)-(2-amino-4-thiazolyl)((2-(2-(3,4-dihydroxybenzoyl)hydrazino)-1,1-dimethyl-2-oxoethoxy)imino)acetyl)amino)-3-((4-(3-carboxy-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-quinolinyl)-1-piperazinyl)methyl)-8-oxo-, 6R,7R)-

Registry Numbers

CAS Registry Number

  • 143488-32-8

System Generated Number

  • 0143488328

Structure Descriptors

InChI

1S/C41H41FN10O12S2/c1-41(2,39(63)47-46-33(56)18-3-6-27(53)28(54)11-18)64-48-29(24-17-66-40(43)44-24)34(57)45-30-35(58)52-31(38(61)62)19(16-65-36(30)52)14-49-7-9-50(10-8-49)26-13-25-21(12-23(26)42)32(55)22(37(59)60)15-51(25)20-4-5-20/h3,6,11-13,15,17,20,30,36,53-54H,4-5,7-10,14,16H2,1-2H3,(H2,43,44)(H,45,57)(H,46,56)(H,47,63)(H,59,60)(H,61,62)/b48-29-/t30-,36-/m1/s1

InChIKey

IXDFVVUXTFRFQQ-MOSWNVLFSA-N

Smiles

C1([C@H]([C@H]2SCC(=C(N12)C(O)=O)CN1CCN(CC1)c1cc2n(cc(c(c2cc1F)=O)C(O)=O)C1CC1)NC(\C(=N/OC(C(NNC(=O)c1cc(O)c(cc1)O)=O)(C)C)c1nc(sc1)N)=O)=O