Cas no 6722-00-5 (Bishomoretinoic acid)
Bishomoretinoic acid structure
Product Name:Bishomoretinoic acid
CAS No:6722-00-5
MF:C22H30O2
MW:326.472406864166
CID:388109
Update Time:2023-08-03
Bishomoretinoic acid Chemical and Physical Properties
Names and Identifiers
-
- 2,4,6,8,10-Undecapentaenoic acid,5,9-dimethyl-11-(2,6,6-trimethyl-1-cyclohexen-1-yl)-,(2E,4E,6E,8E,10E)-
- 9ZG6H07U1D
- Bishomoretinoic acid
- 14'-Apo-beta,psi-carotenoic acid
-
- Inchi： 1S/C22H30O2/c1-17(11-7-13-21(23)24)9-6-10-18(2)14-15-20-19(3)12-8-16-22(20,4)5/h6-7,9-11,13-15H,8,12,16H2,1-5H3,(H,23,24)/b9-6+,13-7+,15-14+,17-11+,18-10+
- InChI Key： CWAIPBKZSWRXCS-SNVHKSNESA-N
- SMILES： OC(/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C)CCCC1(C)C)=O
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 24
- Rotatable Bond Count: 6
- Complexity: 635
- XLogP3: 6.5
- Topological Polar Surface Area: 37.3
Bishomoretinoic acid Related Literature
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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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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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David B. Cordes,Alexandra M. Z. Slawin,Stefania Righetto,Denis Jacquemin,Eli Zysman-Colman,Véronique Guerchais Dalton Trans., 2018,47, 8292-8300
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5. 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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