NLP
Summary
Name: | (1-AMINO-PENTYL)-PHOSPHONIC ACID |
Synonyms: | NORLEUCINE PHOSPHONATE |
Formula: | C5 H14 N O3 P |
Formal charge: | 0 |
Formula weight: | 167.143 Da |
Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | [(1R)-1-aminopentyl]phosphonic acid |
OpenEye OEToolkits | 1.5.0 | [(1R)-1-aminopentyl]phosphonic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=P(O)(O)C(N)CCCC |
SMILES_CANONICAL | CACTVS | 3.341 | CCCC[C@H](N)[P](O)(O)=O |
SMILES | CACTVS | 3.341 | CCCC[CH](N)[P](O)(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCC[C@H](N)P(=O)(O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | CCCCC(N)P(=O)(O)O |
InChI | InChI | 1.03 | InChI=1S/C5H14NO3P/c1-2-3-4-5(6)10(7,8)9/h5H,2-4,6H2,1H3,(H2,7,8,9)/t5-/m1/s1 |
InChIKey | InChI | 1.03 | NXTPDFMZKSLVRK-RXMQYKEDSA-N |