Cas no 19870-31-6 (b-D-Glucopyranose,6-(4-hydroxy-2-methylenebutanoate))
19870-31-6 structure
Product Name:b-D-Glucopyranose,6-(4-hydroxy-2-methylenebutanoate)
CAS No:19870-31-6
MF:C11H18O8
MW:278.255824565887
CID:161217
PubChem ID:119077
Update Time:2025-04-19
b-D-Glucopyranose,6-(4-hydroxy-2-methylenebutanoate) Chemical and Physical Properties
Names and Identifiers
-
- b-D-Glucopyranose,6-(4-hydroxy-2-methylenebutanoate)
- (6-O-(3'-hydroxy-2'-methylenebutyryl))-D-glucopyranose
- 6-tuliposide A
- 6-(4-Hydroxy-2-methylenebutyryl)-D-glucopyranose
- 6-O-(4-hydroxy-2-methylidenebutanoyl)-beta-D-glucopyranose
- beta-D-Glucopyranose, 6-(4-hydroxy-2-methylenebutanoate)
- β-D-Glucopyranose 6-(4-hydroxy-2-methylenebutanoate)
- SCHEMBL2730671
- 6-O-(4-Hydroxy-2-methylidenebutanoyl)hexopyranose
- [(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl 4-hydroxy-2-methylidenebutanoate
- UNII-A67SXQ62FP
- 19870-31-6
- DTXSID30941710
- A67SXQ62FP
- NS00093957
-
- Inchi： 1S/C11H18O8/c1-5(2-3-12)10(16)18-4-6-7(13)8(14)9(15)11(17)19-6/h6-9,11-15,17H,1-4H2/t6-,7-,8+,9-,11-/m1/s1
- InChI Key： NABVFHUVYXEKSQ-ZBGLXGBJSA-N
- SMILES： O1[C@H]([C@@H]([C@H]([C@@H]([C@H]1COC(C(=C)CCO)=O)O)O)O)O
Computed Properties
- Exact Mass: 278.10016753g/mol
- Monoisotopic Mass: 278.10016753g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 5
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 19
- Rotatable Bond Count: 6
- Complexity: 331
- 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: -2.4
- Topological Polar Surface Area: 137?2
b-D-Glucopyranose,6-(4-hydroxy-2-methylenebutanoate) Related Literature
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Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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