BGC > Product Search > 1-epi-Calcitriol | 66791-71-7

Molecular Formula: C27H44O3
Molecular Weight: 416.63646

Description :
Impurity B of Calcitriol is the hormonally active form of vitamin D, and Calcitriol is the active metabolite of vitamin D3 that activates the vitamin D receptor (VDR), which inhibits in vivo and in vitro cell proliferation in a wide range of cells including breast, prostate, colon, skin and brain carcinomas and myeloid leukemia cells.

• Molecular Weight :416.64
• Purity :> 98%

Molecular Formula :
C27H44O3
Canonical SMILES :
CC(CCCC(C)(C)O)C1CCC2C1(CCCC2=CC=C3CC(CC(C3=C)O)O)C
InChI :
InChI=1S/C27H44O3/c1-18(8-6-14-26(3,4)30)23-12-13-24-20(9-7-15-27(23,24)5)10-11-21-16-22(28)17-25(29)19(21)2/h10-11,18,22-25,28-30H,2,6-9,12-17H2,1,3-5H3/b20-10+,21-11-/t18-,22-,23-,24+,25-,27-/m1/s1
InChIKey :
GMRQFYUYWCNGIN-PEJFXWBPSA-N
Synonyms :
1β,25-Dihydroxyvitamin-D3; 1-Epicalcitriol

More details are to be found here

Description :
Impurity B of Calcitriol is the hormonally active form of vitamin D, and Calcitriol is the active metabolite of vitamin D3 that activates the vitamin D receptor (VDR), which inhibits in vivo and in vitro cell proliferation in a wide range of cells including breast, prostate, colon, skin and brain carcinomas and myeloid leukemia cells.

• Molecular Weight :416.64
• Purity :> 98%

Molecular Formula :
C27H44O3
Canonical SMILES :
CC(CCCC(C)(C)O)C1CCC2C1(CCCC2=CC=C3CC(CC(C3=C)O)O)C
InChI :
InChI=1S/C27H44O3/c1-18(8-6-14-26(3,4)30)23-12-13-24-20(9-7-15-27(23,24)5)10-11-21-16-22(28)17-25(29)19(21)2/h10-11,18,22-25,28-30H,2,6-9,12-17H2,1,3-5H3/b20-10+,21-11-/t18-,22-,23-,24+,25-,27-/m1/s1
InChIKey :
GMRQFYUYWCNGIN-PEJFXWBPSA-N
Synonyms :
1β,25-Dihydroxyvitamin-D3; 1-Epicalcitriol

More details are to be found here