PDB CCD ID: | SIC |
Number of entries in BioLiP: | 0 |
Chemical formula: | C7 H10 N2 O4 S |
InChI: | InChI=1S/C7H10N2O4S/c8-3-1-5(10)9(6(3)11)4(2-14)7(12)13/h3-4,14H,1-2,8H2,(H,12,13)/t3-,4-/m0/s1 |
InChIKey: | SZTCYLPUUUGCPP-IMJSIDKUSA-N |
SMILES: | Software | SMILES |
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OpenEye OEToolkits 1.5.0 | C1[C@@H](C(=O)N(C1=O)[C@@H](CS)C(=O)O)N | OpenEye OEToolkits 1.5.0 | C1C(C(=O)N(C1=O)C(CS)C(=O)O)N | ACDLabs 10.04 | O=C1N(C(=O)CC1N)C(C(=O)O)CS | CACTVS 3.341 | N[CH]1CC(=O)N([CH](CS)C(O)=O)C1=O | CACTVS 3.341 | N[C@H]1CC(=O)N([C@@H](CS)C(O)=O)C1=O |
|
Name: | (2R)-2-[(3S)-3-amino-2,5-dioxopyrrolidin-1-yl]-3-sulfanylpropanoic acid |
ZINC: | ZINC000058649622 |