CAS Number3057-04-3
SynonymsMethyl (3α,7α)-3,7-dihydroxycholan-24-oate; Chenodiol methyl ester; Chenodeoxycholic acid methylester; Methyl (3α,5β,7α)-3,7-dihydroxycholan-24-oate; 5β-Cholan-24-oic acid, 3α,7α-dihydroxy-, methyl ester; Methyl chenodeoxycholate; Chenodeoxycholic acid methyl; Methyl (3α,5β,7α,8ξ,20R)-3,7-dihydroxycholan-24-oate; 3α,7α-Dihydroxy-5β-cholan-24-oic Acid Methyl ester
Molecular FormulaC25H42O4
Molecular Weight406.599
Density1.1±0.1 g/cm3
Boiling Point507.6±25.0 °C at 760 mmHg
Melting Point61 °C
AppearanceSolid;White to Light yellow powder to crystal
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 3057-04-3 |
| Catalog No. | 2A-9076943 |
| Chinese Name | 鹅脱氧胆酸甲酯 |
| Synonyms | Methyl (3α,7α)-3,7-dihydroxycholan-24-oate; Chenodiol methyl ester; Chenodeoxycholic acid methylester; Methyl (3α,5β,7α)-3,7-dihydroxycholan-24-oate; 5β-Cholan-24-oic acid, 3α,7α-dihydroxy-, methyl ester; Methyl chenodeoxycholate; Chenodeoxycholic acid methyl; Methyl (3α,5β,7α,8ξ,20R)-3,7-dihydroxycholan-24-oate; 3α,7α-Dihydroxy-5β-cholan-24-oic Acid Methyl ester |
| Molecular Formula | C25H42O4 |
| Molecular Weight | 406.599 |
| Density | 1.1±0.1 g/cm3 |
| Boiling Point | 507.6±25.0 °C at 760 mmHg |
| Melting Point | 61 °C |
| Appearance | Solid;White to Light yellow powder to crystal |
| Storage Condition | room temperature |
| PubChem ID | 16137847 |
| SMILES | COC(=O)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 | GRQROVWZGGDYSW-IFJDUOSNSA-N |
| MSDS | msds/76943_1_3057_04_3.pdf |
| Transport Info | Product Name: Methyl Chenodeoxycholate |
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