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Substance Name: Ecalcidene [USAN:INN]
RN: 150337-94-3
UNII: 7RNN0MXE38
InChIKey: DXWZPQRKPXFQGC-QCUPEZPBSA-N

Classification Code

  • Treatment of Psoriasis

Molecular Formula

  • C29-H45-N-O3

Molecular Weight

  • 455.6785
 
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Names and Synonyms

Name of Substance

  • Ecalcidene
  • Ecalcidene [USAN:INN]

Synonyms

  • Ecalcidene
  • Piperidine, 1-((1alpha,3beta,5Z,7E,20S)-1,3-dihydroxy-24-oxo-9,10-secochola-5,7,10(19)-trien-24-yl)-
  • UNII-7RNN0MXE38

Registry Numbers

CAS Registry Number

  • 150337-94-3

FDA UNII

  • 7RNN0MXE38

System Generated Number

  • 0150337943

Structure Descriptors

InChI

1S/C29H45NO3/c1-20(9-14-28(33)30-16-5-4-6-17-30)25-12-13-26-22(8-7-15-29(25,26)3)10-11-23-18-24(31)19-27(32)21(23)2/h10-11,20,24-27,31-32H,2,4-9,12-19H2,1,3H3/b22-10+,23-11-/t20-,24+,25+,26-,27-,29+/m0/s1

InChIKey

DXWZPQRKPXFQGC-QCUPEZPBSA-N

Smiles

C[C@@H](CCC(=O)N1CCCCC1)[C@H]2CC[C@H]3\C(=C\C=C/4\C[C@@H](O)C[C@H](O)C4=C)\CCC[C@]23C