Dithioerythritol
PubChem CID: 439352
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| Compound Synonyms | Dithioerythritol, 6892-68-8, 1,4-Dithioerythritol, DTE, Dithioerythreitol, 2,3-Butanediol, 1,4-dimercapto-, (2R,3S)-rel-, (2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-DIOL, (2R,3S)-1,4-disulfanylbutane-2,3-diol, erythro-1,4-Dimercapto-2,3-butanediol, (2R,3S)-1,4-bis(sulfanyl)butane-2,3-diol, R4SVL81GQI, 1,4-Dithioerythritol (DTE), CHEBI:17456, ERYTHRITOL, 1,4-DITHIO-, (2R*,3S*)-1,4-dimercapto-2,3-butanediol, EINECS 229-998-8, UNII-R4SVL81GQI, MFCD00063750, 2,3-Butanediol, 1,4-dimercapto-, (R*,S*)-, trans-1,4-Dimercaptobutane-2,3-diol, BRN 1719756, (R*,S*)-1,4-Dimercapto-2,3-butanediol, DTXSID40884341, 3-01-00-02359 (Beilstein Handbook Reference), ERYTHRO-1,4,-DIMERCAPTO-2,3-BUTANEDIOL, 2,3-Butanediol, 1,4-dimercapto-, (theta,S)-, Clelands reagent, Cleland's Reagent, DTE, DTU, 2,3-Dihydroxy-1,4-dithiolbutane, 1,4Dithioerythritol, Erythritol, 1,4dithio, erythro-2,3-Dihydroxy-1,4-butanedithiol, (R*,S*)-1,4-Dimercaptobutane-2,3-diol, SCHEMBL78921, rel-(2R,3S)-1,4-bis(sulfanyl)butane-2,3-diol, 1,4-Dithioerythritol, 99%, CHEMBL1232391, 2,3-Dihydroxy-1,4-butanedithiol, DTXCID801023788, Erythro1,4Dimercapto2,3butanediol, DTT, 1,4-Dithioerythritol, >=99.0%, Erythro2,3Dihydroxy1,4butanedithiol, (R*,S*)1,4Dimercapto2,3butanediol, (R*,S*)1,4Dimercaptobutane2,3diol, AKOS015902817, DB01692, FD07041, FS-4113, HY-15916, 1,4-Dithioerythritol, >=99.0% (RT), 2,3Butanediol, 1,4dimercapto, (R*,S*), 2,3Butanediol, 1,4dimercapto, (theta,S), 1,4-Dithioerythritol, BioXtra, >=99.0%, D1320, NS00070540, (2R*,3S*)-1,4-dimercaptobutane-2,3-diol, 2,3Butanediol, 1,4dimercapto, (2R,3S)rel, (2S,3R)-1,4-bis(sulfanyl)butane-2,3-diol, C00950, D89833, 1,4-Dithioerythritol, BioUltra, >=99.0% (RT), 2,3Butanediol, 1,4dimercapto, (R*,S*) (9CI), Q412701, 2,3-Butanediol, 1,4-dimercapto-, (R*,S*)-(9CI), 1,4-Dithioerythritol, BioReagent, for molecular biology, >=99.0%, erythro-2,3-Dihydroxy-1,4-dithiolbutane, erythro-1,4-Dimercapto-2,3-butanediol, DTE, 229-998-8 |
|---|---|
| Topological Polar Surface Area | 42.5 |
| Hydrogen Bond Donor Count | 4.0 |
| Heavy Atom Count | 8.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 52.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 2.0 |
| Iupac Name | (2R,3S)-1,4-bis(sulfanyl)butane-2,3-diol |
| Nih Violation | False |
| Prediction Hob | 1.0 |
| Xlogp | -0.4 |
| Is Pains | False |
| Molecular Formula | C4H10O2S2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | VHJLVAABSRFDPM-ZXZARUISSA-N |
| Fcsp3 | 1.0 |
| Rotatable Bond Count | 3.0 |
| Compound Name | Dithioerythritol |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 154.012 |
| Formal Charge | 0.0 |
| Brenk Violation | True |
| Monoisotopic Mass | 154.012 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 154.3 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 2.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -0.3274871999999998 |
| Inchi | InChI=1S/C4H10O2S2/c5-3(1-7)4(6)2-8/h3-8H,1-2H2/t3-,4+ |
| Smiles | C([C@H]([C@H](CS)O)O)S |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Camptotheca Acuminata (Plant) Rel Props:Source_db:cmaup_ingredients