Cas no 127852-33-9 (2,6,7-trideoxy-2,6-imino-D-glycero-D-manno-heptitol)
127852-33-9 structure
Product Name:2,6,7-trideoxy-2,6-imino-D-glycero-D-manno-heptitol
CAS No:127852-33-9
MF:C7H15NO4
MW:177.198302507401
CID:2005754
PubChem ID:10986823
Update Time:2025-04-21
2,6,7-trideoxy-2,6-imino-D-glycero-D-manno-heptitol Chemical and Physical Properties
Names and Identifiers
-
- 2,6,7-trideoxy-2,6-imino-D-glycero-D-manno-heptitol
- alpha-7-deoxyhomomannojirimycin
- (2R,3R,4R,5R,6R)-2-(Hydroxymethyl)-6-methyl-3,4,5-piperidinetriol
- SCHEMBL15599046
- 127852-33-9
- DTXSID701168640
-
- Inchi： 1S/C7H15NO4/c1-3-5(10)7(12)6(11)4(2-9)8-3/h3-12H,2H2,1H3
- InChI Key： ZEWFPWKROPWRKE-UHFFFAOYSA-N
- SMILES： CC1C(O)C(O)C(O)C(CO)N1
Computed Properties
- Exact Mass: 177.10010796Da
- Monoisotopic Mass: 177.10010796Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 5
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 154
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 5
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1.9
- Topological Polar Surface Area: 93?2
2,6,7-trideoxy-2,6-imino-D-glycero-D-manno-heptitol Related Literature
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
127852-33-9 (2,6,7-trideoxy-2,6-imino-D-glycero-D-manno-heptitol) Related Products
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