83471-81-2
AlkaPlorer ID: AK105891
Synonym: None
IUPAC Name: (2S)-2-amino-3-[5-[[5-[(2S)-2-amino-2-carboxyethyl]-3-methylimidazol-4-yl]disulfanyl]-1-methylimidazol-4-yl]propanoic acid
Structure
SMILES: CN1C=NC(C[C@H](N)C(=O)O)=C1SSC1=C(C[C@H](N)C(=O)O)N=CN1C
InChI: InChI=1S/C14H20N6O4S2/c1-19-5-17-9(3-7(15)13(21)22)11(19)25-26-12-10(18-6-20(12)2)4-8(16)14(23)24/h5-8H,3-4,15-16H2,1-2H3,(H,21,22)(H,23,24)/t7-,8-/m0/s1
InChIKey: WDDONTKXWRIRLZ-YUMQZZPRSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Setaria italica | Setaria | Poaceae | Poales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Sylvicapra grimmia | Sylvicapra | Bovidae | Artiodactyla | Mammalia | Chordata | Metazoa | Eukaryota |
| Senecio vulgaris | Senecio | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 400.48600000000016
TPSA？: 162.27999999999997
MolLogP？: -0.1381999999999992
Number of H-Donors: 4
Number of H-Acceptors: 10
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|