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Substance Name: Ro 23-4319
RN: 101558-90-1
InChIKey: JYHXCOMHKCOBKF-ZYMHPPEVSA-N

Note

  • Has antiproliferative effect on human colon adenocarcinoma cells.

Molecular Formula

  • C27-H42-O4

Molecular Weight

  • 430.625
 
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Names and Synonyms

Name of Substance

  • Ro 23-4319

Synonyms

  • 1,24,26-Trihydroxy-delta 22-vitamin D3
  • Ro-23-4319

Systematic Name

  • 9,10-Secocholesta-5,7,10(19),22-tetraene-1,3,25,26-tetrol, (1alpha,3beta,5Z,7E,22E,25S)-

Registry Numbers

CAS Registry Number

  • 101558-90-1

System Generated Number

  • 0101558901

Structure Descriptors

InChI

1S/C27H42O4/c1-18(7-5-13-26(3,31)17-28)23-11-12-24-20(8-6-14-27(23,24)4)9-10-21-15-22(29)16-25(30)19(21)2/h5,7,9-10,18,22-25,28-31H,2,6,8,11-17H2,1,3-4H3/b7-5+,20-9-,21-10-/t18-,22-,23-,24+,25+,26+,27-/m1/s1

InChIKey

JYHXCOMHKCOBKF-ZYMHPPEVSA-N

Smiles

C1[C@@H](CC(=C/C=C2/CCC[C@@]3([C@H]2CC[C@@H]3[C@H](C)\C=C\C[C@@](CO)(O)C)C)\C(=C)[C@H]1O)O