beta-D-Galactopyranoside, methyl
PubChem CID: 2108
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| Compound Synonyms | 709-50-2, 2-(hydroxymethyl)-6-methoxyoxane-3,4,5-triol, .beta.-D-Glucopyranoside, methyl, .beta.-D-Galactopyranoside, methyl, .beta.-Methyl-D-galactopyranoside, methyl-D-glucoside, alpha-D-Methylglucoside, .beta.-D-Galactopyranose methyl glycoside, Methyl .beta.-galactoside, Methyl ?-D-Galactopyranoside, 688007-20-7, Glucopyranoside, .alpha.-D-, (D3)METHYL A-D-GLUCOSIDE, .beta.-Methylglucoside, methyl-a-d-galactopyranoside, Methyl, A-D-glucopyranoside, .alpha.-Methyl-D-galactoside, Methyl .alpha.-D-galactoside, methyl, A-d-galactopyranoside, .alpha.-Methyl D-glucose ether, alpha-D-Glucopyranoside, methyl, .alpha.-Methyl-D-galactopyranoside, MFCD08692046, NSC-33684, 1-O-Methyl-.beta.-D-glucopyranoside, Glucopyranoside, methyl, .alpha.-D-, NSC-102101, NSC-214092, Methyl D-galactoside, Methyl-.beta.-galactoside, methyl-a-d-glucopyranoside, Methyl-a-D-mannopyranoside, Methyl ?-D-mannopyranoside, Methyl-b-D-galactopyranoside, NCIOpen2_001794, METHYL-?-D-MANNOSIDE, Mannopyranoside, .alpha.-D-, MLS001049132, .alpha.-Methyl mannopyranoside, SCHEMBL1430362, Methyl-.beta.-D-thiogalactoside, SCHEMBL19738683, SCHEMBL21847893, HOVAGTYPODGVJG-UHFFFAOYSA-, DTXSID60859172, NSC1225, NSC3817, (2R,3R,4S,5R,6S)-2-(Hydroxymethyl)-6-methoxy-tetrahydropyran-3,4,5-triol, HOVAGTYPODGVJG-UHFFFAOYSA-N, HMS2268J22, Methyl, A-D-Glucoside Hemihydrate, DAA39699, NSC-1225, NSC-3817, NSC33684, NSC33685, 1-O-METHYL-BETA-D-GLUCOSIDE, NSC102101, NSC163490, NSC214092, NSC227937, NSC403457, NSC403949, 1-O-METHYL-BETA-D-GALACTOSIDE, AKOS006227638, Galactopyranoside, methyl, .beta.-D-, MM34073, NSC-163490, NSC-227937, NSC-403457, NSC-403949, SB44902, SB45069, Methyl ?-D-Galactopyranoside Monohydrate, NCGC00246215-01, NCGC00246215-02, LS-13353, Mannopyranoside, 1-O-methyl-, alpha-D-, SMR000386958, SY056715, SY066748, SY066776, SY076496, SY112991, .alpha.-D-Galactopyranose methyl glycoside, DB-044463, DB-055468, DB-057669, 1-O-METHYL-ALPHA-D-GLUCOSIDE HYDRATE, NS00014002, Methyl .beta.-D-galactopyranoside, .beta.-D-, AC-907/25014385, 03AFED88-DA24-4BCE-B79F-84CAF2B36351, Methyl .beta.-D-galactopyranoside, methyl, .beta.-D-, InChI=1/C7H14O6/c1-12-7-6(11)5(10)4(9)3(2-8)13-7/h3-11H,2H2,1H3 |
|---|---|
| Topological Polar Surface Area | 99.4 |
| Hydrogen Bond Donor Count | 4.0 |
| Heavy Atom Count | 13.0 |
| Description | Present in Medicago sativa (alfalfa). Methyl beta-D-glucopyranoside is found in cereals and cereal products. |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 163.0 |
| Database Name | cmaup_ingredients;fooddb_chem_all;hmdb_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2-(hydroxymethyl)-6-methoxyoxane-3,4,5-triol |
| Prediction Hob | 1.0 |
| Class | Organooxygen compounds |
| Xlogp | -2.2 |
| Superclass | Organic oxygen compounds |
| Subclass | Carbohydrates and carbohydrate conjugates |
| Molecular Formula | C7H14O6 |
| Prediction Swissadme | 0.0 |
| Inchi Key | HOVAGTYPODGVJG-UHFFFAOYSA-N |
| Fcsp3 | 1.0 |
| Logs | -0.07 |
| Rotatable Bond Count | 2.0 |
| Logd | -1.731 |
| Synonyms | &beta, -d-glucopyranoside, methyl, &beta, -d-methylglucopyranoside, &beta, -methylglucoside, 1-O-Methyl-&beta, -D-glucopyranoside, 1-O-Methyl-Alpha-D-Mannose, 1-O-Methyl-beta-D-glucopyranoside, 2-(hydroxymethyl)-6-methoxytetrahydro-2H-pyran-3,4,5-triol, Alpha-methyl-d -mannoside, Alpha-methyl-d-galactoside, Alpha-methyl-d-glucoside, Alpha-methyl-d-mannoside, Beta-d-glucopyranoside, methyl, Beta-methyl-d-galactoside, Beta-methyl-d-glucoside, Beta-methylglucoside, Glucopyranoside, methyl, &beta, -d-, Methyl &beta, -d-glucopyranoside, Methyl &beta, -d-glucoside, Methyl alpha-d-mannopyranoside, Methyl beta-d-galactoside, Methyl beta-d-glucopyranoside, Methyl beta-d-glucoside, Methyl d-mannopyranoside, Methyl galactoside, Methyl hexopyranoside, Methyl mannoside, Methyl-alpha-d -glucopyranoside, Methyl-alpha-d-mannopyranoside, Methyl-beta-d-galacto-pyranoside, Methyl-beta-galactose, Methylgalactoside, O1-Methyl-Mannose, Methyl b-D-glucopyranoside, Methyl β-D-glucopyranoside, 1-O-Methyl-alpha-D-mannose, 1-O-Methyl-beta -D-glucopyranoside, 2-(Hydroxymethyl)-6-methoxytetrahydro-2H-pyran-3,4,5-triol, alpha-Methyl-D -mannoside, alpha-Methyl-D-galactoside, alpha-Methyl-D-glucoside, alpha-Methyl-D-mannoside, beta -D-Glucopyranoside, methyl, beta -D-Methylglucopyranoside, beta -Methylglucoside, beta-D-Glucopyranoside, methyl, beta-Methyl-D-galactoside, beta-Methyl-D-glucoside, beta-Methylglucoside, Methyl alpha-D-mannopyranoside, Methyl beta -D-glucopyranoside, Methyl beta -D-glucoside, Methyl beta-D-galactoside, Methyl beta-D-glucoside, Methyl D-mannopyranoside, Methyl-alpha-D -glucopyranoside, Methyl-alpha-D-mannopyranoside, Methyl-beta-D-galacto-pyranoside, O1-Methyl-mannose, alpha-Methylmannoside, beta-Methylmannoside, Methyl beta-D-mannopyranoside, Methylmannose, Methylmannoside, alpha-D-isomer, alpha-Methyl-D-mannose, Methylmannoside, alpha-Methylmannose, Methyl mannoside, (alpha-D)-isomer, Methyl-alpha-D-mannoside, Methylglucoside, 13C-labeled, Methyl D-glucopyranoside, Methylglucoside, (beta-D)-isomer, alpha-Methylglucose, Methylglucoside, alpha-Methylglucoside, Methyl-alpha-D-glucoside, Methylglucoside, 2H-labeled, (beta-D)-isomer, Methylglucoside, (alpha-D)-isomer, Methyl D-glucoside, 1-O-Methylglucose, alpha-Methyl-D-glucopyranoside, Methyl-D-glucoside, AlphaMG, Methylglucoside, 6-(13)C-labeled, Methylglucoside, 5-(17)O-labeled, Methyl glucose, Methylglucoside, 13C-labeled, (beta-D)-isomer, Methyl alpha-D-glucopyranoside, Methyl-alpha-glucopyranoside, Methyl alpha-D-glucoside, D-Glucoside, methyl, Methylglucoside, 6-(17)O-labeled, (alpha-L)-isomer, Methyl a-D-galactopyranoside, Methyl α-D-galactopyranoside |
| Compound Name | beta-D-Galactopyranoside, methyl |
| Kingdom | Organic compounds |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 194.079 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 194.079 |
| Hydrogen Bond Acceptor Count | 6.0 |
| Molecular Weight | 194.18 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 5.0 |
| Total Bond Stereocenter Count | 0.0 |
| Molecular Framework | Aliphatic heteromonocyclic compounds |
| Esol | 0.7575653999999999 |
| Inchi | InChI=1S/C7H14O6/c1-12-7-6(11)5(10)4(9)3(2-8)13-7/h3-11H,2H2,1H3 |
| Smiles | COC1C(C(C(C(O1)CO)O)O)O |
| Nring | 1.0 |
| Defined Bond Stereocenter Count | 0.0 |
| Taxonomy Direct Parent | O-glycosyl compounds |
- 1. Outgoing r'ship
FOUND_INto/from Forsythia Suspensa (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Forsythia Viridissima (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Pogostemon Cablin (Plant) Rel Props:Source_db:cmaup_ingredients