(5E)-Calcipotriene
Product Code
TRC-C144210-10MG
CAS Number
Product Format
Neat
Matrix
-
Molecular Formula
C27 H40 O3
Molecular Weight
412.60
Product Categories
TRC, Impurity standards, Chiral molecules, Vitamins and derivatives, Chiral molecules, Vitamins
Product Type
Product Information
CAS Number
113082-99-8
Molecular Formula
C27 H40 O3
Molecular Weight
412.60
Accurate Mass
412.2977
Smiles
C[C@H](\C=C\[C@@H](O)C1CC1)[C@H]2CC[C@H]3\C(=C\C=C\4/C[C@@H](O)C[C@H](O)C4=C)\CCC[C@]23C
InChI
InChI=1S/C27H40O3/c1-17(6-13-25(29)20-8-9-20)23-11-12-24-19(5-4-14-27(23,24)3)7-10-21-15-22(28)16-26(30)18(21)2/h6-7,10,13,17,20,22-26,28-30H,2,4-5,8-9,11-12,14-16H2,1,3H3/b13-6+,19-7+,21-10+/t17-,22-,23-,24+,25-,26+,27-/m1/s1
IUPAC
(1R,3S,5E)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R,5S)-5-cyclopropyl-5-hydroxypent-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol
Storage Temperature
-20C Freezer
Shipping Temperature
Dry ice
Country of Origin
CANADA
Product Type
Impurity
Product Format
Neat
Matrix
-