112875-61-3

112875-61-3 structure
112875-61-3 structure
  • Name: Impurity F of Calcipotriol
  • Chemical Name: (E,1S,4R)-4-[(1R,3aS,4E,7aR)-4-[(2Z)-2-[(3S,5R)-3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-1-cyclopropylpent-2-en-1-ol
  • CAS Number: 112875-61-3
  • Molecular Formula: C39H68O3Si2
  • Molecular Weight: 641.12600
  • Catalog: Signaling Pathways Vitamin D Related VD/VDR
  • Create Date: 2017-09-30 02:37:15
  • Modify Date: 2024-01-04 21:14:37
  • Impurity F of Calcipotriol; Calcipotriol (MC 903; Calcipotriene) is a ligand of VDR-like receptors. IC50 value:Target:Vitamin D3 analog that displays minimal effects on calcium homeostasis. Regulates cell differentiation and proliferation; Calcipotriol (MC 903; Calcipotriene) exhibits antiproliferative activity against human HL-60, HL60/MX2, MCF-7, T47D, SCC-25 and mouse WEHI-3 cancer cell lines.

Name (E,1S,4R)-4-[(1R,3aS,4E,7aR)-4-[(2Z)-2-[(3S,5R)-3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-1-cyclopropylpent-2-en-1-ol
Synonyms 1,3-Bis-O-(tert-butyldimethylsilyl)calcipotriene
(1S,3R)-bis(tert-butyldimethylsilyloxy)-20(R)-(3'(S)-cyclopropyl-3'-hydroxyprop-1'(E)-enyl)-9,10-secopregna-5(Z),7(E),10(19)-triene
1(S),3(R)-bis(tert-butyl-dimethylsilyloxy)-20(R)-(3'-cyclopropyl-3(S)'-hydroxyprop-1'(E)-enyl)-9,10-secopregna-5(Z),7(E),10(19)-triene
UNII-4SP93VP62P
Impurity F of Calcipotriol
Molecular Formula C39H68O3Si2
Molecular Weight 641.12600
Exact Mass 640.47100
PSA 38.69000
LogP 11.14960
Storage condition 2-8℃