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Substance Name: Methacycline trolamine
RN: 41672-87-1
InChIKey: IJOHWAJCUGBYBF-CCHMMTNSSA-N

Note

  • Complex of methacycline with 3 mols of organic base.

Molecular Weight

  • 563.5567
 
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Names and Synonyms

Results Name

  • Methacycline trolamine

Name of Substance

  • Tri-methacycline

Synonym

  • Methacycline trolamine

Systematic Name

  • (4S-(4alpha,4aalpha,5alpha,5aalpha,12aalpha))-4-(Dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,5,10,12,12a-pentahydroxy-6-methylene-1,11-dioxo-2-naphthacenecarboxamide, compd. with 2-amino-2-(hydroxymethyl)-1,3-propanediol (1:3)

Registry Numbers

CAS Registry Number

  • 41672-87-1

Other Registry Numbers

  • 53101-42-1
  • 53126-28-6
  • 70109-06-7

System Generated Number

  • 0041672871

Structure Descriptors

InChI

1S/C22H22N2O8.C4H11NO3/c1-7-8-5-4-6-9(25)11(8)16(26)12-10(7)17(27)14-15(24(2)3)18(28)13(21(23)31)20(30)22(14,32)19(12)29;5-4(1-6,2-7)3-8/h4-6,10,14-15,17,25,27-29,32H,1H2,2-3H3,(H2,23,31);6-8H,1-3,5H2/t10-,14-,15+,17+,22+;/m1./s1

InChIKey

IJOHWAJCUGBYBF-CCHMMTNSSA-N

Smiles

CN(C)[C@H]1[C@@H]2[C@H]([C@@H]3C(=C)c4cccc(c4C(=O)C3=C([C@@]2(C(=O)C(=C1O)C(=O)N)O)O)O)O.C(C(CO)(CO)N)O