1α,25-Dihydroxy-3-epi-vitamin-D3

Product Specifications

CAS Number

61476-45-7

Synonyms

1alpha,25-Dihydroxy-3-epi-vitamin-D3; 1,3-Cyclohexanediol, 4-methylene-5-[(2E)-2-[(1R,3aS,7aR)-octahydro-1-[(1R)-5-hydroxy-1,5-dimethylhexyl]-7a-methyl-4H-inden-4-ylidene]ethylidene]-, (1S,3S,5Z)-; 9,10-Secocholesta-5,7,10(19)-triene-1,3,25-triol, (1α,3α,5Z,7E)- (9CI); (1S,3S,5Z)-4-Methylene-

Hazard Statement

No Data Available

Smiles

C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2\C(=C\C=C/3\C[C@H](O)C[C@H](O)C3=C)\CCC[C@]12C

Molecular Formula

C27 H44 O3

Molecular Weight

416.637

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

Additionnal Information

IUPAC name: (1S,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol