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Methyl 3a,7a-Diacetoxy-12-oxo-5b-cholan-24-oate, TRC

Product Code. 30466135
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50 mg
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Product Code. 30466135 Supplier Toronto Research Chemicals Supplier No. TRCM30350550MG

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Description

High-purity organic molecules and analytical standards, strategically delivered worldwide to empower innovation and commercial success.

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Specifications

Chemical Name or Material Methyl 3alpha,7alpha-Diacetoxy-12-oxo-5beta-cholan-24-oate
CAS 28535-81-1
Molecular Formula C29 H44 O7
Quantity 50 mg
Synonym Cholan-24-oic acid','3,7-bis(acetyloxy)-12-oxo-','methyl ester','(3α,5β,7α)-, 5β-Cholan-24-oic acid','3α,7α-dihydroxy-12-oxo-','methyl ester','diacetate (8CI), 5β-Cholanic acid','3α,7α-dihydroxy-12-oxo-','methyl ester','diacetate (6CI,7CI), 3α,7α-Diacetoxy-12-oxo-5β-cholan-24-oic acid methyl ester, Methyl 3α,7α-diacetoxy-12-oxo-5β-cholan-24-oate, Methyl 3α,7α-diacetoxy-12-oxo-5β-cholanate
InChI Formula InChI=1S/C29H44O7/c1-16(7-10-26(33)34-6)21-8-9-22-27-23(15-25(32)29(21,22)5)28(4)12-11-20(35-17(2)30)13-19(28)14-24(27)36-18(3)31/h16,19-24,27H,7-15H2,1-6H3/t16-,19+,20-,21-,22+,23+,24-,27+,28+,29-/m1/s1
SMILES COC(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@@H](C[C@@H]4C[C@@H](CC[C@]4(C)[C@H]3CC(=O)[C@]12C)OC(=O)C)OC(=O)C
IUPAC Name methyl (4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-diacetyloxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoate
Molecular Weight (g/mol) 504.66
Formula Weight 504.3087
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