Cas no 84594-48-9 (2,6,10,14,20,24,28,32-Octaoxatricyclo[31.3.1.1~15,19~]octatriaconta-1(37),15(38),16,18,33,35-hexaene-5,11,23,29-tetrone)
![2,6,10,14,20,24,28,32-Octaoxatricyclo[31.3.1.1~15,19~]octatriaconta-1(37),15(38),16,18,33,35-hexaene-5,11,23,29-tetrone structure](https://ossimg.kuujia.com/scimg/85000/84594-48-9x500.png)
84594-48-9 structure
Product Name:2,6,10,14,20,24,28,32-Octaoxatricyclo[31.3.1.1~15,19~]octatriaconta-1(37),15(38),16,18,33,35-hexaene-5,11,23,29-tetrone
CAS No:84594-48-9
MF:C30H36O12
MW:588.599650382996
CID:989513
PubChem ID:338573
Update Time:2025-04-20
2,6,10,14,20,24,28,32-Octaoxatricyclo[31.3.1.1~15,19~]octatriaconta-1(37),15(38),16,18,33,35-hexaene-5,11,23,29-tetrone Chemical and Physical Properties
Names and Identifiers
-
- NSC361677
- 2,6,10,14,20,24,28,32-Octaoxatricyclo[31.3.1.1~15,19~]octatriaconta-1(37),15(38),16,18,33,35-hexaene-5,11,23,29-tetrone
- NSC-361677
- 84594-48-9
- DTXSID10320589
-
- Inchi： 1S/C30H36O12/c31-27-9-17-35-23-5-1-6-24(21-23)36-18-10-28(32)40-14-4-16-42-30(34)12-20-38-26-8-2-7-25(22-26)37-19-11-29(33)41-15-3-13-39-27/h1-2,5-8,21-22H,3-4,9-20H2
- InChI Key： PJZSPXNIGRCAQF-UHFFFAOYSA-N
- SMILES： O1C(CCOC2C=CC=C(C=2)OCCC(=O)OCCCOC(CCOC2C=CC=C(C=2)OCCC(=O)OCCC1)=O)=O
Computed Properties
- Exact Mass: 588.22067658g/mol
- Monoisotopic Mass: 588.22067658g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 12
- Heavy Atom Count: 42
- Rotatable Bond Count: 0
- Complexity: 692
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.3
- Topological Polar Surface Area: 142?2
2,6,10,14,20,24,28,32-Octaoxatricyclo[31.3.1.1~15,19~]octatriaconta-1(37),15(38),16,18,33,35-hexaene-5,11,23,29-tetrone Related Literature
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
-
Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
84594-48-9 (2,6,10,14,20,24,28,32-Octaoxatricyclo[31.3.1.1~15,19~]octatriaconta-1(37),15(38),16,18,33,35-hexaene-5,11,23,29-tetrone) Related Products
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