Methyl Chenodeoxycholate

Catalog Number: LP-2497

CAS Number: 3057-04-3

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Specifications

Product Information
Molecular Formula	C25H42O4
Molecular Weight	406.6
Purity	>98%
SMILES	O=C(OC)CCC(C)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CCC12C
InChi	InChI=1S/C25H42O4/c1-15(5-8-22(28)29-4)18-6-7-19-23-20(10-12-25(18,19)3)24(2)11-9-17(26)13-16(24)14-21(23)27/h15-21,23,26-27H,5-14H2,1-4H3/t15-,16+,17-,18-,19+,20+,21-,23+,24+,25-/m1/s1
InChi Key	InChIKey=GRQROVWZGGDYSW-IFJDUOSNSA-N
Alternate Name	5β-Cholan-24-oic acid, 3α,7α-dihydroxy-, methyl ester, 5β-Cholanic acid, 3α,7α-dihydroxy-, methyl ester [...], Methyl (3α,5β,7α)-3,7-dihydroxycholan-24-oate, Methyl 3α,7α-dihydroxy-5β-cholanoate, Methyl chenodeoxycholate, Methyl 3α,7α-dihydroxy-5β-cholan-24-oate, Chenodeoxycholic acid methyl ester
Appearance	Solid
IUPAC Name	Cholan-24-oic acid, 3,7-dihydroxy-, methyl ester, (3α,5β,7α)-

Properties
Storage Conditions	Freezer

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