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Substance Name: 2-(3'-(4-Phenylphenylcarbonyl)-3'-methyl-1'-ureido)-2-(3,4-dihydroxyphenyl)acetamidopenicillanate
RN: 106135-38-0
InChIKey: QLLQREKOSBDHPL-LUWPLTNYSA-M

Molecular Weight

  • 640.646
 
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Names and Synonyms

Name of Substance

  • 2-(3'-(4-Phenylphenylcarbonyl)-3'-methyl-1'-ureido)-2-(3,4-dihydroxyphenyl)acetamidopenicillanate

Synonyms

  • 2-Ppcmudp
  • 2-Ppcmudp sodium salt

Registry Numbers

CAS Registry Number

  • 106135-38-0

System Generated Number

  • 0106135380

Structure Descriptors

InChI

1S/C31H30N4O8S.Na/c1-31(2)24(29(41)42)35-27(40)23(28(35)44-31)32-25(38)22(19-13-14-20(36)21(37)15-19)33-30(43)34(3)26(39)18-11-9-17(10-12-18)16-7-5-4-6-8-16;/h4-15,22-24,28,36-37H,1-3H3,(H,32,38)(H,33,43)(H,41,42);/q;+1/p-1/t22-,23-,24+,28-;/m1./s1

InChIKey

QLLQREKOSBDHPL-LUWPLTNYSA-M

Smiles

N12[C@H](C(C)(C)S[C@@H]1[C@@H](C2=O)NC([C@H](NC(N(C)C(=O)c1ccc(c2ccccc2)cc1)=O)c1cc(c(cc1)O)O)=O)C(=O)[O-].[Na+]