CAS 63283-36-3 Vitamin D3 25-hydroxy monohydrate - Analytical Products / Alfa Chemistry

CAT	APS63283363B
CAS	63283-36-3
Structure
Synonyms	9,10-Secocholesta-5,7,10(19)-triene-3,25-diol, monohydrate, (3beta,5Z,7E)- (9CI),Calcifediol, Vitamin D3 25-hydroxy monohydrate
IUPAC Name	(1S,3Z)-3-[(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-methylidenecyclohexan-1-ol;hydrate
Molecular Weight	418.65
Molecular Formula	C27H44O2.H2O
Canonical SMILES	O.C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2\C(=C\C=C/3\C[C@@H](O)CCC3=C)\CCC[C@]12C
InChI	InChI=1S/C27H44O2.H2O/c1-19-10-13-23(28)18-22(19)12-11-21-9-7-17-27(5)24(14-15-25(21)27)20(2)8-6-16-26(3,4)29;/h11-12,20,23-25,28-29H,1,6-10,13-18H2,2-5H3;1H2/b21-11+,22-12-;/t20-,23+,24-,25+,27-;/m1./s1

Accurate Mass	418.3447
Format	Neat
Shipping	Room Temperature
Storage Conditions	-18°C
Subcategory	Nutritional composition compounds

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