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(5E)-Calcipotriene

CAT: 0572-TRC-C144210-0.5MGSize: 0.5 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-C144210-0.5MGSize:0.5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
113082-99-8
Synonyms
(5E,7E,22E,24S)-24-cyclopropyl-9,10-secochola-5,7,10(19),22-tetraene-1α,3β,24-triol; (5E)-calcipotriol); Calcipotriol Imp. C (EP)
Hazard Statement
Toxic in contact with skin; UN number: UN2811; Packing Group: III
Purity
>95% (HPLC)
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
Molecular Formula
C27 H40 O3
Molecular Weight
412.6
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
Additionnal Information
IUPAC name: (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
Shipping Conditions
Ice Packs
Storage Conditions
-20°C