| PDB CCD ID: | 2WP |
| Number of entries in BioLiP: | 2 |
| Chemical formula: | C9 H17 N O6 S |
| InChI: | InChI=1S/C9H17NO6S/c10-4(8(13)14)1-2-17-3-5-6(11)7(12)9(15)16-5/h4-7,9,11-12,15H,1-3,10H2,(H,13,14)/t4-,5+,6+,7+,9-/m0/s1 |
| InChIKey: | IQFWYNFDWRYSRA-LYNCRYNASA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.7.6 | C(CSC[C@@H]1[C@H]([C@H]([C@H](O1)O)O)O)[C@@H](C(=O)O)N | | CACTVS 3.385 | N[CH](CCSC[CH]1O[CH](O)[CH](O)[CH]1O)C(O)=O | | CACTVS 3.385 | N[C@@H](CCSC[C@H]1O[C@H](O)[C@H](O)[C@@H]1O)C(O)=O | | OpenEye OEToolkits 1.7.6 | C(CSCC1C(C(C(O1)O)O)O)C(C(=O)O)N | | ACDLabs 12.01 | O=C(O)C(N)CCSCC1OC(O)C(O)C1O |
|
| Name: | S-ribosylhomocysteine;
(2S)-2-amino-4-({[(2S,3S,4R,5S)-3,4,5-trihydroxytetrahydrofuran-2-yl]methyl}sulfanyl)butanoic acid |
| ZINC: | ZINC000013544480 |
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