(24S)-Secalciferol
Product Specifications
CAS Number
55700-58-8
Synonyms
2,3-Heptanediol, 2-methyl-6-[(1R,3aS,4E,7aR)-octahydro-4-[(2Z)-2-[(5S)-5-hydroxy-2-methylenecyclohexylidene]ethylidene]-7a-methyl-1H-inden-1-yl]-, (3S,6R)-; 9,10-Secocholesta-5,7,10(19)-triene-3,24,25-triol, (3β,5Z,7E,24S)- (9CI); (3S,6R)-2-Methyl-6-[(1R,3aS,4E,7aR)-octahydro-4-[(2Z)-2-[(5S)-5-hydroxy-2-methylenecyclohexylidene]ethylidene]-7a-methyl-1H-inden-1-yl]-2,3-heptanediol; (24S)-24,25-Dihydroxyvitamin D3; 24S,25-Dihydroxycholecalciferol; (24S)-24,25-Dihydroxycholecalciferol; 24S,25-Dihydroxyvitamin D3; PRI 1202
Hazard Statement
Fatal if swallowed; UN number: UN2811; Packing Group: II
Smiles
C[C@H](CC[C@H](O)C(C)(C)O)[C@H]1CC[C@H]2\C(=C\C=C/3\C[C@@H](O)CCC3=C)\CCC[C@]12C
Molecular Formula
C27 H44 O3
Molecular Weight
416.64
InChI
InChI=1S/C27H44O3/c1-18-8-12-22(28)17-21(18)11-10-20-7-6-16-27(5)23(13-14-24(20)27)19(2)9-15-25(29)26(3,4)30/h10-11,19,22-25,28-30H,1,6-9,12-17H2,2-5H3/b20-10+,21-11-/t19-,22+,23-,24+,25+,27-/m1/s1
Additionnal Information
IUPAC name: (3S,6R)-6-[(1R,3aS,4E,7aR)-4-[(2Z)-2-[(5S)-5-hydroxy-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-2-methylheptane-2,3-diol
Shipping Conditions
Dry Ice
Storage Conditions
-86°C
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