Cas no 121864-94-6 (Agroclavine; (-)-form, 18-Hydroxy, O-[β-D-fructofuranosyl-(2→1)-β-D-fructofuranoside])
![Agroclavine; (-)-form, 18-Hydroxy, O-[β-D-fructofuranosyl-(2→1)-β-D-fructofuranoside] structure](https://ossimg.kuujia.com/scimg/122000/121864-94-6x500.png)
121864-94-6 structure
Product Name:Agroclavine; (-)-form, 18-Hydroxy, O-[β-D-fructofuranosyl-(2→1)-β-D-fructofuranoside]
CAS No:121864-94-6
MF:C28H38N2O11
MW:578.608129024506
CID:6651125
Update Time:2024-03-02
Agroclavine; (-)-form, 18-Hydroxy, O-[β-D-fructofuranosyl-(2→1)-β-D-fructofuranoside] Chemical and Physical Properties
Names and Identifiers
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- Agroclavine; (-)-form, 18-Hydroxy, O-[β-D-fructofuranosyl-(2→1)-β-D-fructofuranoside]
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- Inchi： 1S/C28H38N2O11/c1-30-8-14(5-17-16-3-2-4-18-22(16)15(7-29-18)6-19(17)30)11-38-28(26(37)24(35)21(10-32)41-28)13-39-27(12-33)25(36)23(34)20(9-31)40-27/h2-5,7,17,19-21,23-26,29,31-37H,6,8-13H2,1H3
- InChI Key： NSCOVYKXFRFDBE-UHFFFAOYSA-N
- SMILES： CN1C2CC3C4C(=CC=CC=4C2C=C(COC2(C(O)C(O)C(CO)O2)COC2(C(O)C(O)C(CO)O2)CO)C1)NC=3
Computed Properties
- Hydrogen Bond Donor Count: 8
- Hydrogen Bond Acceptor Count: 13
- Heavy Atom Count: 41
- XLogP3: -2.622
Agroclavine; (-)-form, 18-Hydroxy, O-[β-D-fructofuranosyl-(2→1)-β-D-fructofuranoside] Related Literature
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
121864-94-6 (Agroclavine; (-)-form, 18-Hydroxy, O-[β-D-fructofuranosyl-(2→1)-β-D-fructofuranoside]) Related Products
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