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Substance Name: EINECS 254-798-2
RN: 40126-27-0
InChIKey: GAFPTKDMNOUFNI-FIFSFEKOSA-M

Molecular Formula

  • C21-H25-N3-O6-S.K

Molecular Weight

  • 485.5996
 
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Names and Synonyms

Results Name

  • EINECS 254-798-2

Synonym

  • EINECS 254-798-2

Systematic Name

  • Potassium (2S-(2alpha,5alpha,6beta(S*)))-6-((((3-methoxy-1-methyl-3-oxoprop-1-enyl)amino)phenylacetyl)amino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate

Registry Numbers

CAS Registry Number

  • 40126-27-0

System Generated Number

  • 0040126270

Molecular Formulas

Molecular Formula

  • C21-H25-N3-O6-S.K

Molecular Formula Fragments

  • C21-H25-N3-O6-S
  • COMPONENT
  • K

Structure Descriptors

InChI

1S/C21H25N3O6S.K/c1-11(10-13(25)30-4)22-14(12-8-6-5-7-9-12)17(26)23-15-18(27)24-16(20(28)29)21(2,3)31-19(15)24;/h5-10,14-16,19,22H,1-4H3,(H,23,26)(H,28,29);/q;+1/p-1/b11-10+;/t14?,15-,16+,19-;/m1./s1

InChIKey

GAFPTKDMNOUFNI-FIFSFEKOSA-M

Smiles

N12[C@@H]([C@@H](C1=O)NC(=O)C(N/C(=C/C(=O)OC)C)c1ccccc1)SC([C@@H]2C(=O)[O-])(C)C.[K+]