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Substance Name: Irehdiamine A
RN: 3614-57-1
InChIKey: XDELLWIDOQOKHV-YZXCLFAISA-N

Note

  • Binds to DNA.

Classification Code

  • Mutation Data

Molecular Formula

  • C21-H36-N2

Molecular Weight

  • 316.529
 
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Names and Synonyms

Name of Substance

  • Irehdiamine A

Synonyms

  • Irehdiamine A
  • Irehidamine A

Systematic Names

  • Pregn-5-ene-3,20-diamine, (3-beta,20S)- (9CI)
  • Pregn-5-ene-3-beta,20-alpha-diamine
  • Pregn-5-ene-3beta,20alpha-diamine

Registry Numbers

CAS Registry Number

  • 3614-57-1

System Generated Number

  • 0003614571

Structure Descriptors

InChI

1S/C21H36N2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h4,13,15-19H,5-12,22-23H2,1-3H3/t13-,15-,16-,17+,18-,19-,20-,21+/m0/s1

InChIKey

XDELLWIDOQOKHV-YZXCLFAISA-N

Smiles

N[C@H]1CC[C@@]2([C@H]3CC[C@@]4([C@H](CC[C@@H]4[C@@H]3CC=C2C1)[C@@H](N)C)C)C