CAS 93129-94-3 Tacalcitol monohydrate - Analytical Products / Alfa Chemistry

CAT	APS93129943B
CAS	93129-94-3
Structure
Synonyms	,10-Secocholesta-5,7,10(19)-triene-1,3,24-triol, monohydrate, (1alpha,3beta,5Z,7E,24R)- (9CI), Tacalcitol monohydrate, 1alpha,24(R)-Dihydroxycholecalciferol monohydrate, 1alpha,24(R)-Dihydroxy-vitamin D3 monohydrate,1,3-Cyclohexanediol, 4-methylene-5-[(2E)-2-[(1R,3aS,7aR)-octahydro-1-[(1R,4R)-4-hydroxy-1,5-dimethylhexyl]-7a-methyl-4H-inden-4-ylidene]ethylidene]-, hydrate (1:1), (1R,3S,5Z)-
IUPAC Name	(1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(2R,5R)-5-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol;hydrate
Molecular Weight	434.65
Molecular Formula	C27H44O3.H2O
Canonical SMILES	O.CC(C)[C@H](O)CC[C@@H](C)[C@H]1CC[C@H]2\C(=C\C=C/3\C[C@@H](O)C[C@H](O)C3=C)\CCC[C@]12C
InChI	InChI=1S/C27H44O3.H2O/c1-17(2)25(29)13-8-18(3)23-11-12-24-20(7-6-14-27(23,24)5)9-10-21-15-22(28)16-26(30)19(21)4

Accurate Mass	434.3396
API Family	Matrix - API Family See respective official monograph(s)
Format	Neat
Shipping	Ice pack (-20°C)
Storage Conditions	-20°C
Subcategory	European Pharmacopoeia (Ph. Eur.)
Type	API