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DL-Histidine, monohydrochloride

PubChem CID: 14259267

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Compound Synonyms 6459-59-2, DL-HISTIDINE MONOHYDROCHLORIDE, 2-Amino-3-(1H-imidazol-4-yl)propanoic acid hydrochloride, DL-Histidine hydrochloride, 2-amino-3-(1H-imidazol-5-yl)propanoic acid hydrochloride, DL-Histidine, monohydrochloride, DL-Histidine monoHCl, 2-amino-3-(1H-imidazol-5-yl)propanoic acid, hydrochloride, L-(+)-Histidine monohydrochloride, L-Histidine monohydrochloride, Histidine dihydrochloride, NSC27422, dl-histidine hydrochloride monohydrate, histidin hydrochloride, NSC-27422, HISTIDINE,(L), (--)-Histidinmonohydrochlorid, SCHEMBL139654, QZNNVYOVQUKYSC-UHFFFAOYSA-N, DTXSID401014452, L-Histidine, hydrochloride (1:x), (-)-Histidine monohydrochloride, Histidine hydrochloride, Histidine monohydrochloride, L-Histidine hydrochloride, NSC46706, NSC206275, NSC257867, AKOS015847815, AKOS016367771, FD21742, NSC-206275, laevo-histidine hydrochloride monohydrate, AS-49192, DB-054686, DB-054695, CS-0368312, NS00082207, EN300-74227
Prediction Swissadme 0.0
Topological Polar Surface Area 92.0
Hydrogen Bond Donor Count 4.0
Inchi Key QZNNVYOVQUKYSC-UHFFFAOYSA-N
Fcsp3 0.3333333333333333
Rotatable Bond Count 3.0
Heavy Atom Count 12.0
Compound Name DL-Histidine, monohydrochloride
Prediction Hob Swissadme 0.0
Exact Mass 191.046
Formal Charge 0.0
Monoisotopic Mass 191.046
Isotope Atom Count 0.0
Molecular Complexity 151.0
Hydrogen Bond Acceptor Count 4.0
Molecular Weight 191.61
Database Name cmaup_ingredients;pubchem
Covalent Unit Count 2.0
Defined Atom Stereocenter Count 0.0
Iupac Name 2-amino-3-(1H-imidazol-5-yl)propanoic acid, hydrochloride
Total Atom Stereocenter Count 1.0
Total Bond Stereocenter Count 0.0
Prediction Hob 1.0
Esol 0.3925350666666667
Inchi InChI=1S/C6H9N3O2.ClH/c7-5(6(10)11)1-4-2-8-3-9-4, /h2-3,5H,1,7H2,(H,8,9)(H,10,11), 1H
Smiles C1=C(NC=N1)CC(C(=O)O)N.Cl
Defined Bond Stereocenter Count 0.0
Molecular Formula C6H10ClN3O2

  • 1. Outgoing r'ship FOUND_IN to/from Chelidonium Majus (Plant) Rel Props:Source_db:cmaup_ingredients
  • 2. Outgoing r'ship FOUND_IN to/from Euonymus Grandiflorus (Plant) Rel Props:Source_db:cmaup_ingredients
  • 3. Outgoing r'ship FOUND_IN to/from Gossypium Herbaceum (Plant) Rel Props:Source_db:cmaup_ingredients
  • 4. Outgoing r'ship FOUND_IN to/from Pinellia Ternata (Plant) Rel Props:Source_db:cmaup_ingredients
  • 5. Outgoing r'ship FOUND_IN to/from Pseudostellaria Heterophylla (Plant) Rel Props:Source_db:cmaup_ingredients
  • 6. Outgoing r'ship FOUND_IN to/from Solanum Melongena (Plant) Rel Props:Source_db:cmaup_ingredients
  • 7. Outgoing r'ship FOUND_IN to/from Spinacia Oleracea (Plant) Rel Props:Source_db:cmaup_ingredients
  • 8. Outgoing r'ship FOUND_IN to/from Trifolium Repens (Plant) Rel Props:Source_db:cmaup_ingredients
  • 9. Outgoing r'ship FOUND_IN to/from Urtica Dioica (Plant) Rel Props:Source_db:cmaup_ingredients
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