Cas no 911683-13-1 (7-oxo-20,21,22,23,24,25,26,27-octanor-14,18-cycloapotirucalla-1-en-3,4-olide)
911683-13-1 structure
Product Name:7-oxo-20,21,22,23,24,25,26,27-octanor-14,18-cycloapotirucalla-1-en-3,4-olide
CAS No:911683-13-1
MF:C22H30O3
MW:342.471807003021
CID:2039602
Update Time:2025-03-10
7-oxo-20,21,22,23,24,25,26,27-octanor-14,18-cycloapotirucalla-1-en-3,4-olide Chemical and Physical Properties
Names and Identifiers
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- 7-oxo-20,21,22,23,24,25,26,27-octanor-14,18-cycloapotirucalla-1-en-3,4-olide
- simaroubin E
- 7a,10a-Methano-8H-cyclopenta[5,6]naphth[2,1-c]oxepin-3,11(1H,5aH)-dione, 5b,6,7,9,10,10b,12,12a-octahydro-1,1,5a,10b-tetramethyl-, (5aR,5bR,7aR,10aS,10bR,12aR)-
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- Inchi： 1S/C22H30O3/c1-18(2)15-12-16(23)20(4)14(19(15,3)10-7-17(24)25-18)6-11-21-8-5-9-22(20,21)13-21/h7,10,14-15H,5-6,8-9,11-13H2,1-4H3
- InChI Key： UQTDTFGCPOVWBK-UHFFFAOYSA-N
- SMILES： CC12C3CCC45CCCC4(C3(C)C(=O)CC1C(C)(C)OC(=O)C=C2)C5
Experimental Properties
- Density: 1.171±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- Boiling Point: 491.142±45.00 °C(Press: 760.00 Torr)(predicted)
7-oxo-20,21,22,23,24,25,26,27-octanor-14,18-cycloapotirucalla-1-en-3,4-olide Related Literature
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Hui Liu,Deyong Su,Guolin Cheng,Jimin Xu,Xinyan Wang,Yuefei Hu Org. Biomol. Chem., 2010,8, 1899-1904
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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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3. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Yu Long,Bing Yuan,Jianrui Niu,Xin Tong,Jiantai Ma New J. Chem., 2015,39, 1179-1185
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