Cas no 70956-02-4 (1-Deoxynojirimycin)
1-Deoxynojirimycin structure
Product Name:1-Deoxynojirimycin
1-Deoxynojirimycin Chemical and Physical Properties
Names and Identifiers
-
- 1-Deoxynojirimycin
- (2R,3R,4R,5S)-2-(Hydroxymethyl)-3,4,5-piperidinetriol
- 70956-02-4
- 1oim
- 2-(hydroxymethyl)piperidine-3,4,5-triol
- FT-0694346
- Migalasta
- DTXSID50864871
- NCGC00162154-01
- SCHEMBL19628194
- BCP08136
- NCGC00015383-02
- LXBIFEVIBLOUGU-UHFFFAOYSA-N
- DUVOGLUSTAT; Moranoline; deoxynojirimycin
- CHEMBL11510
- 1-Deoxygalactonojirimycin (DGJ)
- SB47592
- 1,5-Dideoxy-1,5-imino-D-glucitol, 9CI
- Antibiotic S-GI
- NOJ
- SCHEMBL2163281
- SY032317
- NCGC00015383-03
- PD056777
- Lopac0_000444
- BCP15236
- SDCCGSBI-0050429.P002
- BDBM113762
- HMS3865G03
- NCI60_020666
- 1-Deoxy-Nojirimycin
- Duvoglustat (hydrochloride)
- FT-0665842
- 2-hydroxymethyl-3,4,5-trihydroxypiperidine
- Duvoglustat pound>>BAY-h-5955 pound>>D-1-Deoxynojirimycin pound>>1-dNM pound>>Moranoline
- CCG-204536
- LS-13202
- SCHEMBL21104989
-
- Inchi： 1S/C6H13NO4/c8-2-3-5(10)6(11)4(9)1-7-3/h3-11H,1-2H2
- InChI Key： LXBIFEVIBLOUGU-UHFFFAOYSA-N
- SMILES： OC1C(C(CNC1CO)O)O
Computed Properties
- Exact Mass: 163.08445790g/mol
- Monoisotopic Mass: 163.08445790g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 5
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 132
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: -2.3
- Topological Polar Surface Area: 93?2
Experimental Properties
- LogP: -1.80
1-Deoxynojirimycin Related Literature
-
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
-
Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
-
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
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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