Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 5-alpha-Androstan-17-one, 3-alpha-hydroxy-, (p-(bis(2-chloroethyl)amino)phenyl)acetate
ID: BV80586500
InChIKey: MSKANHIOTCWNTD-VZBQOHLMSA-N

Classification Codes

  • Hormone
  • Mutation Data

Molecular Formula

  • C31-H43-Cl2-N-O3

Molecular Weight

  • 548.5907
 
* denotes mobile formatted website

Links to Resources


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 3-alpha-Hydroxy-5-alpha-androstan-17-one (p-(bis(2-chloroethyl)amino)phenyl)acetate
  • Androsterone ester of p-bis(2-chloroethyl)aminophenylacetic acid

Systematic Name

  • 5-alpha-Androstan-17-one, 3-alpha-hydroxy-, (p-(bis(2-chloroethyl)amino)phenyl)acetate

Registry Numbers

ID Number

  • NIOSH/BV8058650

System Generated Number

  • BV80586500

Structure Descriptors

InChI

1S/C31H43Cl2NO3/c1-30-13-11-24(37-29(36)19-21-3-6-23(7-4-21)34(17-15-32)18-16-33)20-22(30)5-8-25-26-9-10-28(35)31(26,2)14-12-27(25)30/h3-4,6-7,22,24-27H,5,8-20H2,1-2H3/t22-,24+,25-,26-,27-,30-,31-/m0/s1

InChIKey

MSKANHIOTCWNTD-VZBQOHLMSA-N

Smiles

C[C@]12CC[C@H](C[C@@H]1CC[C@@H]3[C@@H]2CC[C@@]4(C)[C@H]3CCC4=O)OC(=O)Cc5ccc(cc5)N(CCCl)CCCl