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Substance Name: 3-Hydroxy-7-(hydroxyimino)cholanic acid
RN: 131204-64-3
InChIKey: BTJWQMQHCORTED-MBKKHDIZSA-N

Molecular Weight

  • 405.575
 
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Names and Synonyms

Name of Substance

  • 3-Hydroxy-7-(hydroxyimino)cholanic acid

Synonyms

  • HHCA
  • Lca-7-oxime

Registry Numbers

CAS Registry Number

  • 131204-64-3

System Generated Number

  • 0131204643

Structure Descriptors

InChI

1S/C24H39NO4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(26)12-15(23)13-20(22)25-29/h14-19,22,26,29H,4-13H2,1-3H3,(H,27,28)/b25-20-/t14-,15?,16?,17-,18+,19+,22+,23+,24-/m1/s1

InChIKey

BTJWQMQHCORTED-MBKKHDIZSA-N

Smiles

C1[C@@H](C[C@@H]2C\C([C@H]3[C@@H]4CC[C@@H]([C@@H](CCC(=O)O)C)[C@@]4(C)CC[C@H]3[C@@]2(C1)C)=N\O)O