Methyl alpha-D-mannopyranoside
PubChem CID: 101798
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| Compound Synonyms | Methyl alpha-D-mannopyranoside, 617-04-9, Methyl a-D-mannopyranoside, Methyl alpha-D-mannoside, Methyl-alpha-D-mannopyranoside, alpha-Methyl-D-mannoside, methyl, A-d-mannopyranoside, alpha-Methyl mannopyranoside, 1-O-Methyl-alpha-D-mannopyranoside, alpha-Methyl-D-mannopyranoside, alpha-D-Methyl mannoside, Methyl-alpha-D-mannoside, alpha-Methyl-D-(-)-mannoside, (2R,3S,4S,5S,6S)-2-(hydroxymethyl)-6-methoxyoxane-3,4,5-triol, CHEBI:43943, .alpha.-D-Mannopyranoside, methyl, MFCD00063262, Methyl alpha-D-mannoside (VAN), C7H14O6, NSC 1225, EINECS 210-502-3, 25281-48-5, NSC 224429, .alpha.-D-Methyl mannoside, .alpha.-Methyl-D-mannoside, Methyl .alpha.-D-mannoside, (2R,3S,4S,5S,6S)-2-(hydroxymethyl)-6-methoxytetrahydro-2H-pyran-3,4,5-triol, CHEMBL195368, alpha-D-Mannopyranoside, methyl, .alpha.-Methyl-D-mannopyranoside, Methyl .alpha.-D-mannopyranoside, Methyl-.alpha.-D-mannopyranoside, DTXSID10897266, Methylmannoside, METHYL ?-D-MANNOSIDE, alpha-Methylmannose, beta-Methylmannoside, alpha-Methylmannoside, alpha-methyl-D-mannose, Methylmannoside, alpha-D-isomer, Methyl mannoside, (alpha-D)-isomer, 2jdn, 2jdy, Mannopyranoside, methyl, .alpha.-D-, methyl a-d-mannoside, methyl-a-d-mannoside, a-methyl-D-mannoside, a-Methyl D-mannoside, alphaDMethyl mannoside, Methyl alphaDmannoside, alphaMethylD()mannoside, 1ws5, 2bv4, a-Methyl mannopyranoside, alpha-Methyl D-mannoside, methyl -d-mannopyranoside, Methyl I+--D-mannoside, Methyl-I+--D-mannoside, alphaMethylDmannopyranoside, alphaMethyl mannopyranoside, Epitope ID:145662, 1OMethylalphaDmannopyranoside, alphaDMannopyranoside, methyl, Methyl-alphaD-mannopyranoside, Methyl alphaDmannoside (VAN), SCHEMBL136446, Mannopyranoside, methyl, alphaD, 1-O-Methyl-a-D-mannopyranoside, DTXCID401326649, Mannopyranoside, methyl, alpha-D-, 1-O-Methyl-I+--D-mannopyranoside, BDBM50166886, CCG-53954, s5047, 1-O-Methyl-.alpha.-D-mannopyranoside, AKOS016010476, DB01979, HY-W039897, MM06730, Mannopyranoside, methyl, alphaD (8CI), AS-58701, DA-65396, CS-0098154, M0368, NS00069872, Methyl alpha-D-mannopyranoside, >=99% (GC), F16319, SR-01000643077-1, Q27093072, Methyl alpha-D-mannopyranoside, for microbiology, >=99.0%, 35B8275C-EB56-4981-81A0-8E358215B1A9, (2R,3S,4S,5S,6S)-2-(hydroxymethyl)-6-methoxy-tetrahydropyran-3,4,5-triol, O1-METHYL-MANNOSE, methyl alpha-D-mannoside, methyl D-mannoside, methyl mannoside, 210-502-3 |
|---|---|
| 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;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 5.0 |
| Uniprot Id | P02866, P08191, B4EH87, Q9HYN5 |
| Iupac Name | (2R,3S,4S,5S,6S)-2-(hydroxymethyl)-6-methoxyoxane-3,4,5-triol |
| Prediction Hob | 1.0 |
| Xlogp | -2.2 |
| Molecular Formula | C7H14O6 |
| Prediction Swissadme | 0.0 |
| Inchi Key | HOVAGTYPODGVJG-VEIUFWFVSA-N |
| Fcsp3 | 1.0 |
| Logs | 0.041 |
| Rotatable Bond Count | 2.0 |
| Logd | -1.778 |
| Compound Name | Methyl alpha-D-mannopyranoside |
| 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 Lilium Lancifolium (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all