Catalog Number:
AG0081RH
Chemical Name:
Bis-O-(tert-butyldimethylsilyl)-trans-calcipotriol
CAS Number:
112849-27-1
Molecular Formula:
C39H68O3Si2
Molecular Weight:
641.1264
MDL Number:
MFCD09952331
IUPAC Name:
(E,1S,4R)-4-[(1R,3aS,4E,7aR)-4-[(2E)-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
InChI:
InChI=1S/C39H68O3Si2/c1-27(16-23-35(40)30-18-19-30)33-21-22-34-29(15-14-24-39(33,34)9)17-20-31-25-32(41-43(10,11)37(3,4)5)26-36(28(31)2)42-44(12,13)38(6,7)8/h16-17,20,23,27,30,32-36,40H,2,14-15,18-19,21-22,24-26H2,1,3-13H3/b23-16+,29-17+,31-20+/t27-,32-,33-,34+,35-,36+,39-/m1/s1
InChI Key:
DIMYHZDULFSWLS-YFSXTQNDSA-N
SMILES:
O=C1CCC(C1)CC(C1CCC2C1(C)CCC/C/2=C/C=C/1\CC(CC(C1=C)O[Si](C(C)(C)C)(C)C)O[Si](C(C)(C)C)(C)C)C
