SNC
S-NITROSO-CYSTEINE
Created: | 1999-07-08 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 15 |
Chiral Atom Count | 1 |
Bond Count | 14 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | S-NITROSO-CYSTEINE |
Systematic Name (OpenEye OEToolkits) | (2R)-2-amino-3-nitrososulfanyl-propanoic acid |
Formula | C3 H6 N2 O3 S |
Molecular Weight | 150.156 |
Type | L-PEPTIDE LINKING |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(O)C(N)CSN=O |
SMILES | CACTVS | 3.341 | N[CH](CSN=O)C(O)=O |
SMILES | OpenEye OEToolkits | 1.5.0 | C(C(C(=O)O)N)SN=O |
Canonical SMILES | CACTVS | 3.341 | N[C@@H](CSN=O)C(O)=O |
Canonical SMILES | OpenEye OEToolkits | 1.5.0 | C([C@@H](C(=O)O)N)SN=O |
InChI | InChI | 1.03 | InChI=1S/C3H6N2O3S/c4-2(3(6)7)1-9-5-8/h2H,1,4H2,(H,6,7)/t2-/m0/s1 |
InChIKey | InChI | 1.03 | XOWVFANEOZMPKG-REOHCLBHSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 9793848 |
ChEMBL | CHEMBL300676 |
ChEBI | CHEBI:138935 |