Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Melitracen methanesulfonate
RN: 31149-47-0
UNII: HS8YY1BM7I
InChIKey: LXKCTBYAJVUILB-UHFFFAOYSA-N

Molecular Formula

  • C21-H25-N.C-H4-O3-S

Molecular Weight

  • 387.5411
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Melitracen methanesulfonate

Synonyms

  • EINECS 250-489-1
  • UNII-HS8YY1BM7I

Systematic Name

  • 3-(10,10-Dimethyl-9(10H)-anthrylidene)propyl(dimethyl)ammonium methanesulphonate

Registry Numbers

CAS Registry Number

  • 31149-47-0

FDA UNII

  • HS8YY1BM7I

System Generated Number

  • 0031149470

Molecular Formulas

Molecular Formula

  • C21-H25-N.C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C21-H25-N
  • COMPONENT

Structure Descriptors

InChI

1S/C21H25N.CH4O3S/c1-21(2)19-13-7-5-10-17(19)16(12-9-15-22(3)4)18-11-6-8-14-20(18)21;1-5(2,3)4/h5-8,10-14H,9,15H2,1-4H3;1H3,(H,2,3,4)

InChIKey

LXKCTBYAJVUILB-UHFFFAOYSA-N

Smiles

C1(=C\CC[NH+](C)C)\c2c(C(c3c1cccc3)(C)C)cccc2.S(=O)(=O)([O-])C