Cas no 126026-41-3 (12-Hydroxy-6,7-secoabieta-8,11,13-triene-6,7-dial)
126026-41-3 structure
Product Name:12-Hydroxy-6,7-secoabieta-8,11,13-triene-6,7-dial
CAS No:126026-41-3
MF:C19H26O3
MW:302.407946109772
CID:6766173
Update Time:2024-03-03
12-Hydroxy-6,7-secoabieta-8,11,13-triene-6,7-dial Chemical and Physical Properties
Names and Identifiers
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- 12-Hydroxy-6,7-secoabieta-8,11,13-triene-6,7-dial
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- Inchi： 1S/C19H26O3/c1-5-13-9-14(11-20)15(10-16(13)22)19(4)8-6-7-18(2,3)17(19)12-21/h9-12,17,22H,5-8H2,1-4H3/t17-,19+/m0/s1
- InChI Key： NVNFXDJNNBHVGI-PKOBYXMFSA-N
- SMILES： C1(C=C(CC)C(O)=CC=1[C@@]1([C@@H](C=O)C(C)(C)CCC1)C)C=O
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 22
- XLogP3: 4.08
12-Hydroxy-6,7-secoabieta-8,11,13-triene-6,7-dial Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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