PDB CCD ID: | DYS |
Number of entries in BioLiP: | 0 |
Chemical formula: | C11 H16 N2 O4 S |
InChI: | InChI=1S/C11H16N2O4S/c12-2-1-6-3-8(14)10(15)9(4-6)18-5-7(13)11(16)17/h3-4,7,14-15H,1-2,5,12-13H2,(H,16,17)/t7-/m0/s1 |
InChIKey: | BZYHBWCVRKSWDB-ZETCQYMHSA-N |
SMILES: | Software | SMILES |
---|
OpenEye OEToolkits 1.5.0 | c1c(cc(c(c1O)O)SCC(C(=O)O)N)CCN | CACTVS 3.341 | NCCc1cc(O)c(O)c(SC[CH](N)C(O)=O)c1 | OpenEye OEToolkits 1.5.0 | c1c(cc(c(c1O)O)SC[C@@H](C(=O)O)N)CCN | CACTVS 3.341 | NCCc1cc(O)c(O)c(SC[C@H](N)C(O)=O)c1 | ACDLabs 10.04 | O=C(O)C(N)CSc1cc(cc(O)c1O)CCN |
|
Name: | S-[5-(2-aminoethyl)-2,3-dihydroxyphenyl]-L-cysteine |