Cas no 72811-81-5 (1-O-{3-[(3-O-hexopyranosylhexopyranosyl)oxy]-28-oxoolean-12-en-28-yl}hexopyranose)
![1-O-{3-[(3-O-hexopyranosylhexopyranosyl)oxy]-28-oxoolean-12-en-28-yl}hexopyranose structure](https://ossimg.kuujia.com/scimg/73000/72811-81-5x500.png)
72811-81-5 structure
Product Name:1-O-{3-[(3-O-hexopyranosylhexopyranosyl)oxy]-28-oxoolean-12-en-28-yl}hexopyranose
CAS No:72811-81-5
MF:C48H78O18
MW:943.122137546539
CID:977546
PubChem ID:434121
Update Time:2025-04-19
1-O-{3-[(3-O-hexopyranosylhexopyranosyl)oxy]-28-oxoolean-12-en-28-yl}hexopyranose Chemical and Physical Properties
Names and Identifiers
-
- 1-O-{3-[(3-O-hexopyranosylhexopyranosyl)oxy]-28-oxoolean-12-en-28-yl}hexopyranose
- [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 10-[3,5-dihydroxy-6-(hydroxymethyl)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,1
- 72811-81-5
- NSC342983
- DTXSID90330984
- ANCHUSOSIDE-7
- NSC-342983
- Anchucoside-7
-
- Inchi： 1S/C48H78O18/c1-43(2)14-16-48(42(60)66-40-36(58)34(56)31(53)25(20-50)62-40)17-15-46(6)22(23(48)18-43)8-9-28-45(5)12-11-29(44(3,4)27(45)10-13-47(28,46)7)64-41-37(59)38(32(54)26(21-51)63-41)65-39-35(57)33(55)30(52)24(19-49)61-39/h8,23-41,49-59H,9-21H2,1-7H3
- InChI Key： MHCDFIFLMYBWIV-UHFFFAOYSA-N
- SMILES： O(C1C(C(C(C(CO)O1)O)OC1C(C(C(C(CO)O1)O)O)O)O)C1CCC2(C)C(CCC3(C)C4(C)CCC5(C(=O)OC6C(C(C(C(CO)O6)O)O)O)CCC(C)(C)CC5C4=CCC32)C1(C)C
Computed Properties
- Exact Mass: 942.51894
- Monoisotopic Mass: 942.519
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 11
- Hydrogen Bond Acceptor Count: 18
- Heavy Atom Count: 66
- Rotatable Bond Count: 10
- Complexity: 1800
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 23
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.5
- Topological Polar Surface Area: 295?2
Experimental Properties
- Density: 1.41
- Boiling Point: 1002.8°C at 760 mmHg
- Flash Point: 284.3°C
- Refractive Index: 1.623
- PSA: 294.98
- LogP: 0.14050
1-O-{3-[(3-O-hexopyranosylhexopyranosyl)oxy]-28-oxoolean-12-en-28-yl}hexopyranose Related Literature
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
-
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
-
Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
72811-81-5 (1-O-{3-[(3-O-hexopyranosylhexopyranosyl)oxy]-28-oxoolean-12-en-28-yl}hexopyranose) Related Products
- 65497-07-6(Esculentoside A)
- 39524-08-8(Asperosaponin VI)
- 107870-05-3(Urs-12-ene-27,28-dioicacid, 3-[(6-deoxy-b-D-glucopyranosyl)oxy]-, (3b)-)
- 102040-03-9(Tubeimoside I)
- 129741-57-7(Pulchinenoside C)
- 35286-58-9(Ziyuglycoside I)
- 14216-03-6(Hederacoside C)
- 16830-15-2(Asiaticoside)
- 34540-22-2(Madecassoside)
- 58479-68-8(Platycodin D)
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