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ScientificNameLabel
Homocystine
PHCD compound ID : 5038
Chemical Names :
Homocystine
Molecular Formula : C8H16N2O4S2
Molecular Weight : 268.055149
More Details :
Names & Synonyms: 2-amino-4-[(3-amino-3-carboxy-propyl)disulfanyl]butanoic acid , 2-amino-4-[(3-amino-3-carboxypropyl)disulfanyl]butanoic acid , 2-azanyl-4-[(3-azanyl-4-oxidanyl-4-oxidanylidene-butyl)disulfanyl]butanoic acid , 2-amino-4-[(3-amino-3-carboxy-propyl)disulfanyl]butyric acid
Smiles: N[C@H](C(=O)O)CCSSCC[C@@H](C(=O)O)N
InChi : InChI=1S/C8H16N2O4S2/c9-5(7(11)12)1-3-15-16-4-2-6(10)8(13)14/h5-6H,1-4,9-10H2,(H,11,12)(H,13,14)/t5-,6-/m0/s1
InChi Key : InChIKey=ZTVZLYBCZNMWCF-WDSKDSINSA-N
PubChem ID : 10010
Rotatable bond count : 9 Rule of five : 0
Hydrogen bond acceptor count : 6 Ionization potential : 8.912081
Hydrogen bond donor count : 4 Electric dipole moment : 1.898
XLogP : -2.596 VDW volume : 235.823894
Molecular weight : 268.055149 HOMO-LUMO gap : 8.002000
Herb list :
Refrences & Litretures:
  
785.      Journal:'J. Agric. Food Chem'      Year:'1967'      Volume:'15'      Page:'1040'      DOI:'10.1021/jf60154a024'      Title:'Mushroom ninhydrin-positive compounds. Amino acids, related compounds, and other nitrogenous substances found in cultivated mushroom, Agaricus campestris'
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