Cas no 1002727-29-8 (15,16-Dihydroxy-4,8(19),13-xeniaphyllatrien-12-one; (4E,13E,15ξ)-form)
1002727-29-8 structure
Product Name:15,16-Dihydroxy-4,8(19),13-xeniaphyllatrien-12-one; (4E,13E,15ξ)-form
CAS No:1002727-29-8
MF:C20H30O3
MW:318.450406551361
CID:6750032
Update Time:2024-03-03
15,16-Dihydroxy-4,8(19),13-xeniaphyllatrien-12-one; (4E,13E,15ξ)-form Chemical and Physical Properties
Names and Identifiers
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- (+)-Gibberosin J
- 15,16-Dihydroxy-4,8(19),13-xeniaphyllatrien-12-one; (4E,13E,15ξ)-form
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- Inchi： 1S/C20H30O3/c1-14-6-5-7-15(2)16-12-20(4,17(16)9-8-14)18(22)10-11-19(3,23)13-21/h6,10-11,16-17,21,23H,2,5,7-9,12-13H2,1,3-4H3
- InChI Key： PIHJJPQEXCTUBJ-UHFFFAOYSA-N
- SMILES： CC1CCC2C(CC2(C(C=CC(CO)(O)C)=O)C)C(=C)CCC=1
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 23
- XLogP3: 2.884
15,16-Dihydroxy-4,8(19),13-xeniaphyllatrien-12-one; (4E,13E,15ξ)-form Related Literature
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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