Methyl alpha-D-glucopyranoside
PubChem CID: 64947
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| Compound Synonyms | Methyl alpha-D-glucopyranoside, 97-30-3, Methyl-alpha-D-glucopyranoside, alpha-Methylglucoside, Methyl alpha-D-glucoside, alpha-Methyl-D-glucoside, alpha-Methyl D-glucose ether, methyl a-d-glucopyranoside, (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-methoxyoxane-3,4,5-triol, alpha-MDG, Me alpha-Glc, .alpha.-D-Glucopyranoside, methyl, alpha-D-Methylglucoside, alpha-D-methyl glucoside, 1-O-methyl-alpha-D-glucoside, 1-O-methyl-alpha-D-glucopyranose, CHEBI:320061, Methyl, A-D-glucoside, .alpha.-Methylglucoside, (2R,3S,4S,5R,6S)-2-(Hydroxymethyl)-6-methoxytetrahydro-2H-pyran-3,4,5-triol, 1-O-methyl-alpha-D-glucopyranoside, MFCD00064086, Methyl .alpha.-D-glucoside, QCF122NF3R, DTXSID7026605, Methyl .alpha.-D-glucopyranoside, Methyl, A-D-glucopyranoside, Methyl ?-D-Glucopyranoside, methyl glucose, alphaMG, alpha-D-Glucopyranoside, methyl, .alpha.-Methyl D-glucose ether, GYP, Methyl alpha-D-glucoside (VAN), ALPHA-METHYL GLUCOSIDE, EINECS 202-571-3, alpha-D-Glucoside, methyl, UNII-QCF122NF3R, NSC 102101, AI3-18790, MalphaDG, Glucopyranoside, methyl, .alpha.-D-, alpha-methyl-D-glucose pyranoside, Me-alpha-Glc, NSC-102101, NSC-214092, Glucopyranoside, methyl, alpha-D-, 1-O-METHYL-.ALPHA.-D-GLUCOSIDE, METHYL .ALPHA.-D-(+)-GLUCOSIDE, a-methyl-D-glucoside, 1-O-METHYL-.ALPHA.-D-GLUCOPYRANOSIDE, 1ws4, Methyl hexopyranoside #, a-D-methyl glucopyranoside, Epitope ID:150073, methyl alpha-D-glucopyranose, SCHEMBL50473, alpha-D-methyl glucopyranoside, .alpha.-Methyl-(d)-glucoside, .alpha.-d-Methylglucopyranoside, CHEMBL131853, DTXCID806605, GTPL4640, Methyl alpha -D-glucopyranoside, BDBM20876, methyl alpha-(D)-glucopyranoside, 1-Methyl-alpha-D-glucopyranoside, Tox21_200430, [14C]alpha-methyl-D-glucopyranoside, .ALPHA.-METHYLGLUCOSIDE [MI], alpha-methyl-D-glucopyranoside (AMG), AKOS015896548, CS-W021034, HY-W040294, MM03961, CAS-97-30-3, Methyl alpha-D-glucopyranoside, >=99%, NCGC00257984-01, AS-14322, M0228, NS00078809, EN300-92952, P16421, Q27074402, BE2A51F8-C121-4E44-89AB-05A013F8AA57, Methyl alpha-D-glucopyranoside, for microbiology, >=99.0% |
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| Topological Polar Surface Area | 99.4 |
| Hydrogen Bond Donor Count | 4.0 |
| Heavy Atom Count | 13.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 163.0 |
| Database Name | cmaup_ingredients;fooddb_chem_all;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 5.0 |
| Uniprot Id | P11216, P24173 |
| Iupac Name | (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-methoxyoxane-3,4,5-triol |
| Prediction Hob | 1.0 |
| Target Id | NPT2824 |
| Xlogp | -2.2 |
| Molecular Formula | C7H14O6 |
| Prediction Swissadme | 0.0 |
| Inchi Key | HOVAGTYPODGVJG-ZFYZTMLRSA-N |
| Fcsp3 | 1.0 |
| Logs | 0.096 |
| Rotatable Bond Count | 2.0 |
| Logd | -1.846 |
| Compound Name | Methyl alpha-D-glucopyranoside |
| 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 |
| 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/t3-,4-,5+,6-,7+/m1/s1 |
| Smiles | CO[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O |
| Nring | 1.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Forsythia Suspensa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 2. Outgoing r'ship
FOUND_INto/from Forsythia Viridissima (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all