C6C
S-CYCLOHEXYL THIOCYSTEINE
| Created: | 1999-07-08 |
| Last modified: | 2024-09-27 |
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Chemical Details | |
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| Formal Charge | 0 |
| Atom Count | 31 |
| Chiral Atom Count | 1 |
| Bond Count | 31 |
| Aromatic Bond Count | 0 |
Chemical Component Summary | |
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| Name | S-CYCLOHEXYL THIOCYSTEINE |
| Systematic Name (OpenEye OEToolkits) | (2R)-2-amino-3-cyclohexyldisulfanyl-propanoic acid |
| Formula | C9 H17 N O2 S2 |
| Molecular Weight | 235.367 |
| Type | L-PEPTIDE LINKING |
Chemical Descriptors | |||
|---|---|---|---|
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C(N)CSSC1CCCCC1 |
| SMILES | CACTVS | 3.341 | N[CH](CSSC1CCCCC1)C(O)=O |
| SMILES | OpenEye OEToolkits | 1.5.0 | C1CCC(CC1)SSCC(C(=O)O)N |
| Canonical SMILES | CACTVS | 3.341 | N[C@@H](CSSC1CCCCC1)C(O)=O |
| Canonical SMILES | OpenEye OEToolkits | 1.5.0 | C1CCC(CC1)SSC[C@@H](C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C9H17NO2S2/c10-8(9(11)12)6-13-14-7-4-2-1-3-5-7/h7-8H,1-6,10H2,(H,11,12)/t8-/m0/s1 |
| InChIKey | InChI | 1.03 | DYOSZCUUPLADPV-QMMMGPOBSA-N |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 49866755 |














