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ScientificNameLabel
Dopa
PHCD compound ID : 2643
Chemical Names :
Dopa
Molecular Formula : C9H11N1O4
Molecular Weight : 197.068808
More Details :
Names & Synonyms: 2-amino-3-(3,4-dihydroxyphenyl)propanoic acid , 2-azanyl-3-[3,4-bis(oxidanyl)phenyl]propanoic acid , 2-amino-3-(3,4-dihydroxyphenyl)propionic acid
Smiles: OC(=O)[C@H](Cc1ccc(c(c1)O)O)N
InChi : InChI=1S/C9H11NO4/c10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h1-2,4,6,11-12H,3,10H2,(H,13,14)/t6-/m0/s1
InChi Key : InChIKey=WTDRDQBEARUVNC-LURJTMIESA-N
PubChem ID : 836
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 5 Ionization potential : 8.931017
Hydrogen bond donor count : 4 Electric dipole moment : 2.006
XLogP : -2.363 VDW volume : 176.575694
Molecular weight : 197.068808 HOMO-LUMO gap : 8.805000
Herb list :
Refrences & Litretures:
  
309.      Journal:'BioMed Research International'      Year:'2015'      Volume:''      Page:'925631'      DOI:'10.1155/2015/925631'      Title:'Portulaca oleracea L.: A Review of Phytochemistry and Pharmacological Effects'
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