LYV
O-phosphono-L-seryl-N-[(3S)-3-amino-3-carboxypropyl]glycinamide
Created: | 2013-12-06 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 41 |
Chiral Atom Count | 2 |
Bond Count | 40 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | O-phosphono-L-seryl-N-[(3S)-3-amino-3-carboxypropyl]glycinamide |
Systematic Name (OpenEye OEToolkits) | (2S)-2-azanyl-4-[2-[[(2S)-2-azanyl-3-phosphonooxy-propanoyl]amino]ethanoylamino]butanoic acid |
Formula | C9 H19 N4 O8 P |
Molecular Weight | 342.243 |
Type | L-PEPTIDE LINKING |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=P(OCC(C(=O)NCC(=O)NCCC(C(=O)O)N)N)(O)O |
SMILES | CACTVS | 3.385 | N[CH](CCNC(=O)CNC(=O)[CH](N)CO[P](O)(O)=O)C(O)=O |
SMILES | OpenEye OEToolkits | 1.7.6 | C(CNC(=O)CNC(=O)C(COP(=O)(O)O)N)C(C(=O)O)N |
Canonical SMILES | CACTVS | 3.385 | N[C@@H](CCNC(=O)CNC(=O)[C@@H](N)CO[P](O)(O)=O)C(O)=O |
Canonical SMILES | OpenEye OEToolkits | 1.7.6 | C(CNC(=O)CNC(=O)[C@H](COP(=O)(O)O)N)[C@@H](C(=O)O)N |
InChI | InChI | 1.03 | InChI=1S/C9H19N4O8P/c10-5(9(16)17)1-2-12-7(14)3-13-8(15)6(11)4-21-22(18,19)20/h5-6H,1-4,10-11H2,(H,12,14)(H,13,15)(H,16,17)(H2,18,19,20)/t5-,6-/m0/s1 |
InChIKey | InChI | 1.03 | OAHBGBOPVNAMDO-WDSKDSINSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 137349718 |