RM0
2-[(~{E})-hydroxyiminomethyl]-6-(5-morpholin-4-ylpentyl)pyridin-3-ol
Created: | 2017-10-30 |
Last modified: | 2018-11-14 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 44 |
Chiral Atom Count | 0 |
Bond Count | 45 |
Aromatic Bond Count | 6 |
Chemical Component Summary | |
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Name | 2-[(~{E})-hydroxyiminomethyl]-6-(5-morpholin-4-ylpentyl)pyridin-3-ol |
Systematic Name (OpenEye OEToolkits) | 2-[(~{E})-hydroxyiminomethyl]-6-(5-morpholin-4-ylpentyl)pyridin-3-ol |
Formula | C15 H23 N3 O3 |
Molecular Weight | 293.361 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | ON=Cc1nc(CCCCCN2CCOCC2)ccc1O |
SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(c(nc1CCCCCN2CCOCC2)C=NO)O |
Canonical SMILES | CACTVS | 3.385 | O\N=C\c1nc(CCCCCN2CCOCC2)ccc1O |
Canonical SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(c(nc1CCCCCN2CCOCC2)/C=N/O)O |
InChI | InChI | 1.03 | InChI=1S/C15H23N3O3/c19-15-6-5-13(17-14(15)12-16-20)4-2-1-3-7-18-8-10-21-11-9-18/h5-6,12,19-20H,1-4,7-11H2/b16-12+ |
InChIKey | InChI | 1.03 | DHXJJCCCAIXLRS-FOWTUZBSSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 135567430 |