Cas no 119240-18-5 (3-epi-ignavinol)
3-epi-ignavinol structure
Product Name:3-epi-ignavinol
CAS No:119240-18-5
MF:C20H27NO4
MW:345.432686090469
CID:2032396
Update Time:2025-04-21
3-epi-ignavinol Chemical and Physical Properties
Names and Identifiers
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- 3-epi-ignavinol
-
- Inchi： 1S/C20H27NO4/c1-8-9-3-10-14-19-6-12(22)16(24)17(2)7-21(14)11(13(17)19)5-18(10,15(8)23)20(19,25)4-9/h9-16,22-25H,1,3-7H2,2H3/t9-,10+,11-,12+,13+,14+,15+,16+,17+,18-,19+,20-/m0/s1
- InChI Key： IZAMPMCOQUBWAE-HBRPIUTPSA-N
- SMILES： [C@H]1(C[C@@]23[C@H]4[C@@H]5[C@@]6([C@@]2(O)C[C@H](C5)C([C@H]6O)=C)C[C@H]2[C@@H]3[C@](CN24)(C)[C@@H]1O)O
Computed Properties
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 25
- XLogP3: -0.435
3-epi-ignavinol Related Literature
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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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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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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