Cas no 28245-12-7 (beta-D-Galactopyranosyl-(1→6)-beta-D-galactopyranosyl-(1→6)-D-galactose)
28245-12-7 structure
Product Name:beta-D-Galactopyranosyl-(1→6)-beta-D-galactopyranosyl-(1→6)-D-galactose
CAS No:28245-12-7
MF:C18H32O16
MW:504.437088012695
CID:1999513
PubChem ID:101703006
Update Time:2025-04-21
beta-D-Galactopyranosyl-(1→6)-beta-D-galactopyranosyl-(1→6)-D-galactose Chemical and Physical Properties
Names and Identifiers
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- beta-D-Galactopyranosyl-(1→6)-beta-D-galactopyranosyl-(1→6)-D-galactose
- (2R,3S,4S,5R)-2,3,4,5-Tetrahydroxy-6-(((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-((((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)hexanal
- 28245-12-7
-
- Inchi： 1S/C18H32O16/c19-1-5(21)9(23)10(24)6(22)3-31-17-16(30)14(28)12(26)8(34-17)4-32-18-15(29)13(27)11(25)7(2-20)33-18/h1,5-18,20-30H,2-4H2/t5-,6+,7+,8+,9+,10-,11-,12-,13-,14-,15+,16+,17+,18+/m0/s1
- InChI Key： FZWBNHMXJMCXLU-DQCIVCCDSA-N
- SMILES： O1[C@H]([C@@H]([C@H]([C@H]([C@H]1CO[C@H]1[C@@H]([C@H]([C@H]([C@@H](CO)O1)O)O)O)O)O)O)OC[C@H]([C@@H]([C@@H]([C@H](C=O)O)O)O)O
Computed Properties
- Exact Mass: 504.16903493g/mol
- Monoisotopic Mass: 504.16903493g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 11
- Hydrogen Bond Acceptor Count: 16
- Heavy Atom Count: 34
- Rotatable Bond Count: 11
- Complexity: 625
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 14
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -7.2
- Topological Polar Surface Area: 277?2
beta-D-Galactopyranosyl-(1→6)-beta-D-galactopyranosyl-(1→6)-D-galactose Related Literature
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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