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Substance Name: N-(2-Aminoethyl)-3,7-dihydroxycholan-24-amide
RN: 78793-10-9
InChIKey: PJQVFKBWSMRJQG-BJLOMENOSA-N

Molecular Weight

  • 434.6604
 
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Names and Synonyms

Name of Substance

  • N-(2-Aminoethyl)-3,7-dihydroxycholan-24-amide

Synonyms

  • N-(2-Aminoethyl)-3alpha,7alpha-dihydroxy-5beta-cholan-24-amide
  • Nae-3,7-dhca

Systematic Name

  • Cholan-24-amide, N-(2-aminoethyl)-3,7-dihydroxy-, (3alpha,5beta,7alpha)-

Registry Numbers

CAS Registry Number

  • 78793-10-9

System Generated Number

  • 0078793109

Structure Descriptors

InChI

1S/C26H46N2O3/c1-16(4-7-23(31)28-13-12-27)19-5-6-20-24-21(9-11-26(19,20)3)25(2)10-8-18(29)14-17(25)15-22(24)30/h16-22,24,29-30H,4-15,27H2,1-3H3,(H,28,31)/t16-,17+,18-,19-,20+,21+,22-,24+,25+,26-/m1/s1

InChIKey

PJQVFKBWSMRJQG-BJLOMENOSA-N

Smiles

C[C@H](CCC(=O)NCCN)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C