Cas no 2680526-70-7 ((3α,5β,7α,12α)-3,7,12-Trihydroxy-24-(2-methoxy-3-indolizinyl)cholan-24-one)
2680526-70-7 structure
Product Name:(3α,5β,7α,12α)-3,7,12-Trihydroxy-24-(2-methoxy-3-indolizinyl)cholan-24-one
CAS No:2680526-70-7
MF:C33H47NO5
MW:537.729990243912
CID:6642397
Update Time:2024-01-29
(3α,5β,7α,12α)-3,7,12-Trihydroxy-24-(2-methoxy-3-indolizinyl)cholan-24-one Chemical and Physical Properties
Names and Identifiers
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- (3α,5β,7α,12α)-3,7,12-Trihydroxy-24-(2-methoxy-3-indolizinyl)cholan-24-one
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- Inchi： 1S/C33H47NO5/c1-19(8-11-26(36)31-28(39-4)17-21-7-5-6-14-34(21)31)23-9-10-24-30-25(18-29(38)33(23,24)3)32(2)13-12-22(35)15-20(32)16-27(30)37/h5-7,14,17,19-20,22-25,27,29-30,35,37-38H,8-13,15-16,18H2,1-4H3/t19-,20+,22-,23-,24+,25+,27-,29+,30+,32+,33-/m1/s1
- InChI Key： WAVMOOBFNOSEBZ-SXQSIHBPSA-N
- SMILES： [C@H]1(O)C[C@]2([H])[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@]([C@@H](O)C1)(C)[C@@H]([C@H](C)CCC(C1N4C(=CC=1OC)C=CC=C4)=O)CC3)[C@H](O)C2
Experimental Properties
- Density: 1.32±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)
- pka: 14.64±0.70(Predicted)
(3α,5β,7α,12α)-3,7,12-Trihydroxy-24-(2-methoxy-3-indolizinyl)cholan-24-one Related Literature
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1. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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