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Substance Name: Homo-aza-steroidal ester
RN: 131959-74-5
InChIKey: HYLPWZVQLIFGBY-GFYOBVKKSA-N

Molecular Formula

  • C33-H48-Cl2-N2-O3

Molecular Weight

  • 591.6592
 
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Names and Synonyms

Results Name

  • Homo-aza-steroidal ester

Synonyms

  • 17beta-Hydroxy-4-aza-A-homo-5alpha-androstan-3-one p-(N,N-bis(2-chloroethyl)amino)phenylbutyrate
  • Homo-aza-steroidal ester
  • NSC 622555

Systematic Name

  • 4-Aza-A-homoandrostan-3-one, 17-(4-(4-(bis(2-chloroethyl)amino)phenyl)-1-oxobutoxy)-, (5alpha,17beta)-

Registry Numbers

CAS Registry Number

  • 131959-74-5

System Generated Number

  • 0131959745

Structure Descriptors

InChI

1S/C33H48Cl2N2O3/c1-32-17-15-30(38)36-22-24(32)8-11-26-27-12-13-29(33(27,2)16-14-28(26)32)40-31(39)5-3-4-23-6-9-25(10-7-23)37(20-18-34)21-19-35/h6-7,9-10,24,26-29H,3-5,8,11-22H2,1-2H3,(H,36,38)/t24-,26-,27-,28-,29-,32-,33-/m0/s1

InChIKey

HYLPWZVQLIFGBY-GFYOBVKKSA-N

Smiles

C[C@]12CCC(=O)NC[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4OC(=O)CCCc5ccc(cc5)N(CCCl)CCCl)C