alpha-GLUCOSAMINE, D-
PubChem CID: 445621
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | alpha-D-glucosamine, alpha-Glucosamine, alpha-Glucosamine, D-, Glucosamine alpha-form, UNII-S3BL0640UV, 6490-70-6, S3BL0640UV, 2-amino-2-deoxy-alpha-D-glucopyranose, Glucosamine alpha-form [MI], alpha-D-Glucopyranose, 2-amino-2-deoxy-, Glucopyranose, 2-amino-2-deoxy-, alpha-D-, (2S,3R,4R,5S,6R)-3-amino-6-(hydroxymethyl)oxane-2,4,5-triol, CHEBI:44678, D-alpha-glucosamine, .alpha.-D-Glucopyranose, 2-amino-2-deoxy-, .ALPHA.-GLUCOSAMINE, Glucopyranose, 2-amino-2-deoxy-, .alpha.-D-, .ALPHA.-D-GLUCOSAMINE, SCHEMBL429222, GLUCOSAMINE .ALPHA.-FORM, MSWZFWKMSRAUBD-UKFBFLRUSA-, .ALPHA.-GLUCOSAMINE, D-, GLUCOSAMINE .ALPHA.-FORM [MI], BRD-K70131229-003-01-2, Q27104534, WURCS=2.0/1,1,0/(a2122h-1a_1-5_2*N)/1/, (2S,3R,4R,5S,6R)-3-Amino-6-(hydroxymethyl)tetrahydro-2H-pyran-2,4,5-triol, InChI=1/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3-,4-,5-,6+/m1/s1 |
|---|---|
| Topological Polar Surface Area | 116.0 |
| Hydrogen Bond Donor Count | 5.0 |
| Heavy Atom Count | 12.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 155.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 5.0 |
| Iupac Name | (2S,3R,4R,5S,6R)-3-amino-6-(hydroxymethyl)oxane-2,4,5-triol |
| Prediction Hob | 1.0 |
| Xlogp | -2.8 |
| Molecular Formula | C6H13NO5 |
| Prediction Swissadme | 0.0 |
| Inchi Key | MSWZFWKMSRAUBD-UKFBFLRUSA-N |
| Fcsp3 | 1.0 |
| Logs | -0.045 |
| Rotatable Bond Count | 1.0 |
| Logd | -2.046 |
| Compound Name | alpha-GLUCOSAMINE, D- |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 179.079 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 179.079 |
| Hydrogen Bond Acceptor Count | 6.0 |
| Molecular Weight | 179.17 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 5.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | 1.3201336000000004 |
| Inchi | InChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3-,4-,5-,6+/m1/s1 |
| Smiles | C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O)N)O)O)O |
| Nring | 1.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Agathosma Scaberula (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Balanophora Harlandii (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Cichorium Intybus (Plant) Rel Props:Source_db:cmaup_ingredients - 4. Outgoing r'ship
FOUND_INto/from Euphorbia Biglandulosa (Plant) Rel Props:Source_db:cmaup_ingredients - 5. Outgoing r'ship
FOUND_INto/from Lupinus Cosentinii (Plant) Rel Props:Source_db:cmaup_ingredients - 6. Outgoing r'ship
FOUND_INto/from Phaseolus Vulgaris (Plant) Rel Props:Source_db:cmaup_ingredients - 7. Outgoing r'ship
FOUND_INto/from Polemonium Caeruleum (Plant) Rel Props:Source_db:cmaup_ingredients - 8. Outgoing r'ship
FOUND_INto/from Rehmannia Glutinosa (Plant) Rel Props:Source_db:cmaup_ingredients - 9. Outgoing r'ship
FOUND_INto/from Strychnos Ledermannii (Plant) Rel Props:Source_db:cmaup_ingredients - 10. Outgoing r'ship
FOUND_INto/from Viburnum Davidii (Plant) Rel Props:Source_db:cmaup_ingredients