Cas no 70424-54-3 (Castelanone)
Castelanone structure
Product Name:Castelanone
CAS No:70424-54-3
MF:C25H34O9
MW:478.532068729401
CID:975117
Update Time:2024-03-01
Castelanone Chemical and Physical Properties
Names and Identifiers
-
- castelanone
- Picras-3-ene-2,16-dione, 11,20-epoxy-1,11,12-trihydroxy-15-(3-methyl-1-oxobutoxy)-, (1beta,11beta,12alpha,15beta)-
- NSC312626
- C08755
- Q27106091
- Castelanone
-
- Inchi： 1S/C25H34O9/c1-10(2)6-16(27)34-18-17-12(4)19(28)25(31)22-23(5)13(11(3)7-14(26)20(23)29)8-15(33-21(18)30)24(17,22)9-32-25/h7,10,12-13,15,17-20,22,28-29,31H,6,8-9H2,1-5H3/t12-,13+,15-,17-,18-,19-,20-,22-,23-,24+,25+/m1/s1
- InChI Key： XYGCQTNZODZWCL-RWTXECNMSA-N
- SMILES： O1C[C@@]23[C@H]4C[C@H]5C(C)=CC([C@H]([C@]5(C)[C@H]2[C@@]1([C@@H]([C@H](C)[C@@H]3[C@H](C(=O)O4)OC(CC(C)C)=O)O)O)O)=O
Computed Properties
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 9
- Heavy Atom Count: 34
- Rotatable Bond Count: 4
- Complexity: 973
- Topological Polar Surface Area: 140
- XLogP3: 1.532
Castelanone Related Literature
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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4. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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