Cas no 640-90-4 ((3alpha,5beta,12alpha,16alpha)-3,12,16-Trihydroxycholan-24-oic acid)
640-90-4 structure
Product Name:(3alpha,5beta,12alpha,16alpha)-3,12,16-Trihydroxycholan-24-oic acid
CAS No:640-90-4
MF:C24H40O5
MW:408.57140827179
CID:2001279
Update Time:2025-03-11
(3alpha,5beta,12alpha,16alpha)-3,12,16-Trihydroxycholan-24-oic acid Chemical and Physical Properties
Names and Identifiers
-
- (3alpha,5beta,12alpha,16alpha)-3,12,16-Trihydroxycholan-24-oic acid
- Cholan-24-oic acid, 3,12,16-trihydroxy-, (3α,5β,12α,16α)-
-
- Inchi： 1S/C24H40O5/c1-13(4-7-21(28)29)22-19(26)11-18-16-6-5-14-10-15(25)8-9-23(14,2)17(16)12-20(27)24(18,22)3/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)
- InChI Key： ZUZXRORWWYAGIY-UHFFFAOYSA-N
- SMILES： CC(C1C2(C(C3C(CC2O)C2(C(CC(CC2)O)CC3)C)CC1O)C)CCC(=O)O
Experimental Properties
- Density: 1.184±0.06 g/cm3(Predicted)
- Melting Point: 188-189 °C
- Boiling Point: 583.9±45.0 °C(Predicted)
- pka: 4.76±0.10(Predicted)
(3alpha,5beta,12alpha,16alpha)-3,12,16-Trihydroxycholan-24-oic acid Related Literature
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
Related Categories
- Solvents and Organic Chemicals Organic Compounds Lipids and lipid-like molecules Steroids and steroid derivatives Hydroxy bile acids, alcohols and derivatives
- Solvents and Organic Chemicals Organic Compounds Lipids and lipid-like molecules Steroids and steroid derivatives Bile acids, alcohols and derivatives Hydroxy bile acids, alcohols and derivatives
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