Record Information |
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Version | 1.0 |
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Created at | 2021-01-05 22:03:14 UTC |
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Updated at | 2021-07-15 17:12:39 UTC |
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NP-MRD ID | NP0012764 |
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Secondary Accession Numbers | None |
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Natural Product Identification |
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Common Name | Carpatamide A |
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Provided By | NPAtlas |
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Description | Carpatamide A is found in Streptomyces sp. It was first documented in 2014 (PMID: 24754815). Based on a literature review very few articles have been published on (2E,4E)-N-[2,4-dihydroxy-5-(3-methoxy-3-oxopropyl)phenyl]-7-methylocta-2,4-dienimidic acid. |
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Structure | [H]OC1=C([H])C(O[H])=C(N([H])C(=O)C(\[H])=C(/[H])\C(\[H])=C(/[H])C([H])([H])C([H])(C([H])([H])[H])C([H])([H])[H])C([H])=C1C([H])([H])C([H])([H])C(=O)OC([H])([H])[H] InChI=1S/C19H25NO5/c1-13(2)7-5-4-6-8-18(23)20-15-11-14(9-10-19(24)25-3)16(21)12-17(15)22/h4-6,8,11-13,21-22H,7,9-10H2,1-3H3,(H,20,23)/b5-4+,8-6+ |
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Synonyms | Value | Source |
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(2E,4E)-N-[2,4-Dihydroxy-5-(3-methoxy-3-oxopropyl)phenyl]-7-methylocta-2,4-dienimidate | Generator |
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Chemical Formula | C19H25NO5 |
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Average Mass | 347.4110 Da |
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Monoisotopic Mass | 347.17327 Da |
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IUPAC Name | methyl 3-{2,4-dihydroxy-5-[(2E,4E)-7-methylocta-2,4-dienamido]phenyl}propanoate |
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Traditional Name | methyl 3-{2,4-dihydroxy-5-[(2E,4E)-7-methylocta-2,4-dienamido]phenyl}propanoate |
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CAS Registry Number | Not Available |
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SMILES | COC(=O)CCC1=CC(NC(=O)\C=C\C=C\CC(C)C)=C(O)C=C1O |
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InChI Identifier | InChI=1S/C19H25NO5/c1-13(2)7-5-4-6-8-18(23)20-15-11-14(9-10-19(24)25-3)16(21)12-17(15)22/h4-6,8,11-13,21-22H,7,9-10H2,1-3H3,(H,20,23)/b5-4+,8-6+ |
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InChI Key | ALSDCMNNZQSKDG-DVBIZMGNSA-N |
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Experimental Spectra |
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| Not Available | Predicted Spectra |
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| Spectrum Type | Description | Depositor ID | Depositor Organization | Depositor | Deposition Date | View |
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1D NMR | 13C NMR Spectrum (1D, 25 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 100 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 252 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 1000 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 50 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 200 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 75 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 300 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 101 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 400 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 126 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 500 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 151 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 600 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 176 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 700 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 201 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 800 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 226 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 900 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum |
| Chemical Shift Submissions |
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| Not Available | Species |
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Species of Origin | |
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Chemical Taxonomy |
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Classification | Not classified |
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Physical Properties |
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State | Not Available |
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Experimental Properties | Property | Value | Reference |
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Melting Point | Not Available | Not Available | Boiling Point | Not Available | Not Available | Water Solubility | Not Available | Not Available | LogP | Not Available | Not Available |
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Predicted Properties | |
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