Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1,2-Cholanthrenediol, cis-3-methyl-
RN: 3342-99-2
InChIKey: MSPGUHVGYWHMPY-LEWJYISDSA-N

Classification Code

  • Tumor Data

Molecular Formula

  • C21-H16-O2

Molecular Weight

  • 300.355
 
* 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

Synonyms

  • Benz(j)aceanthrylene-1,2-diol, 1,2-dihydro-3-methyl-, cis-
  • cis-1,2-Dihydroxy-3-methylcholanthrene
  • cis-3-Methylcholanthrene-1,2-diol

Systematic Name

  • 1,2-Cholanthrenediol, cis-3-methyl-

Registry Numbers

CAS Registry Number

  • 3342-99-2

System Generated Number

  • 0003342992

Structure Descriptors

InChI

1S/C21H16O2/c1-11-6-7-13-10-16-14-5-3-2-4-12(14)8-9-15(16)19-18(13)17(11)20(22)21(19)23/h2-10,20-23H,1H3/t20-,21+/m0/s1

InChIKey

MSPGUHVGYWHMPY-LEWJYISDSA-N

Smiles

c12[C@@H]([C@@H](c3c4ccc5ccccc5c4cc(ccc1C)c23)O)O