Trehalose, dihydrate
PubChem CID: 181978
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| Compound Synonyms | D-(+)-Trehalose dihydrate, 6138-23-4, Trehalose dihydrate, D-Trehalose dihydrate, alpha,alpha-Trehalose dihydrate, TREHALOSE, DIHYDRATE, MFCD00071594, a,a-D-Trehalose dihydrate, 7YIN7J07X4, (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-3,4,5-triol, dihydrate, DTXSID3047972, alpha-D-Glucopyranoside, alpha-D-glucopyranosyl, dihydrate, a,a-Trehalose, (2R,2'R,3S,3'S,4S,4'S,5R,5'R,6R,6'R)-6,6'-Oxybis(2-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol) dihydrate, UNII-7YIN7J07X4, Trehalose dihydrate, a-d-Glucopyranosyl a-d-glucopyranoside dihydrate (a,a-trehalose dihydrate), MYCOSE DIHYDRATE, D-Trehalose, ,-Trehalose, 99-20-7 (anhydrous), SCHEMBL166078, CHEMBL3188936, DTXCID9027948, FEMA NO. 4600, TREHALOSE DIHYDRATE [MI], Trehalose dihydrate, cell culture, CHEBI:232797, HMS3885G16, .alpha.-D-Glucopyranoside, .alpha.-D-glucopyranosyl, dihydrate, Tox21_201106, Trehalose (for injection) (sterile), TREHALOSE DIHYDRATE [WHO-DD], a-d-glucopyranosyl-a-d-glucopyranoside, AKOS016010526, CCG-268385, OT05313, OT06976, OT72471, a,a-D-Trehalose dihydrate - high purity, a,a-D-Trehalose dihydrate endotoxin free, NCGC00258658-01, AS-11785, BP-20564, DA-72521, TREHALOSE DIHYDRATE [EP MONOGRAPH], CAS-6138-23-4, D-Trehalose dihydrate, ,-Trehalose dihydrate, S3992, .ALPHA., .ALPHA.-TREHALOSE DIHYDRATE, D-Trehalose dihydrate 1000 microg/mL in Water, D70602, a-D-Glucopyranosyl-a-D-glucopyranoside dihydrate, Q27269028, D-(+)-Trehalose dihydrate, for microbiology, >=99.0%, D-(+)-Trehalose dihydrate, SAJ special grade, >=99.0%, D-(+)-Trehalose dihydrate, Vetec(TM) reagent grade, >=99%, Trehalose, United States Pharmacopeia (USP) Reference Standard, .ALPHA.-D-GLUCOPYRANOSYL-.ALPHA.-D-GLUCOPYRANOSIDE DIHYDRATE, D-(+)-Trehalose dihydrate, from Saccharomyces cerevisiae, >=99%, Trehalose dihydrate, European Pharmacopoeia (EP) Reference Standard, D-(+)-Trehalose dihydrate, from Saccharomyces cerevisiae, >=98.5% (HPLC), Trehalose, Pharmaceutical Secondary Standard, Certified Reference Material, a-D-Glucopyranosyl-a-D-glucopyranoside dihydrate, Trehalose, D-Trehalose dihydrate, D-(+)-Trehalose dihydrate (D-Trehalose dihydrate, alpha,alpha-Trehalose dihydrate), (2R,2'R,3S,3'S,4S,4'S,5R,5'R,6R,6'R)-6,6'-Oxybis(2-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol)dihydrate, D-(+)-Trehalose dihydrate, from Saccharomyces cerevisiae, BioReagent, plant cell culture tested, D-(+)-Trehalose dihydrate, from Saccharomyces cerevisiae, powder, BioReagent, suitable for cell culture, suitable for insect cell culture, >=99% |
|---|---|
| Topological Polar Surface Area | 192.0 |
| Hydrogen Bond Donor Count | 10.0 |
| Heavy Atom Count | 25.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 348.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 10.0 |
| Uniprot Id | n.a. |
| Iupac Name | (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-3,4,5-triol, dihydrate |
| Prediction Hob | 0.0 |
| Molecular Formula | C12H26O13 |
| Prediction Swissadme | 0.0 |
| Inchi Key | DPVHGFAJLZWDOC-PVXXTIHASA-N |
| Fcsp3 | 1.0 |
| Logs | -0.158 |
| Rotatable Bond Count | 4.0 |
| Logd | -3.039 |
| Compound Name | Trehalose, dihydrate |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 378.137 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 378.137 |
| Hydrogen Bond Acceptor Count | 13.0 |
| Molecular Weight | 378.33 |
| Covalent Unit Count | 3.0 |
| Total Atom Stereocenter Count | 10.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | 1.3102725999999996 |
| Inchi | InChI=1S/C12H22O11.2H2O/c13-1-3-5(15)7(17)9(19)11(21-3)23-12-10(20)8(18)6(16)4(2-14)22-12, , /h3-20H,1-2H2, 2*1H2/t3-,4-,5-,6-,7+,8+,9-,10-,11-,12-, , /m1../s1 |
| Smiles | C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O)O)O.O.O |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Pogostemon Cablin (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all