Record Information |
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Version | 1.0 |
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Created at | 2022-09-12 16:52:40 UTC |
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Updated at | 2022-09-12 16:52:40 UTC |
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NP-MRD ID | NP0330988 |
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Secondary Accession Numbers | None |
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Natural Product Identification |
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Common Name | (1s,3s,13s,14r,17s,18s,19s,20r,21s,22r,24r,25s)-21,22,24-tris(acetyloxy)-20-[(acetyloxy)methyl]-18,25-dihydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.0¹,²⁰.0³,²³.0⁷,¹²]pentacosa-7,9,11-trien-19-yl pyridine-3-carboxylate |
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Description | (1s,3s,13s,14r,17s,18s,19s,20r,21s,22r,24r,25s)-21,22,24-tris(acetyloxy)-20-[(acetyloxy)methyl]-18,25-dihydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.0¹,²⁰.0³,²³.0⁷,¹²]pentacosa-7,9,11-trien-19-yl pyridine-3-carboxylate is found in Euonymus japonicus. Based on a literature review very few articles have been published on Euojaponine M. |
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Structure | C[C@H]1[C@@H](C)C(=O)O[C@H]2[C@@H](O)[C@@H](OC(=O)C3=CC=CN=C3)[C@]3(COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)C4[C@@H](OC(C)=O)[C@]3(O[C@]4(C)COC(=O)C3=CC=CN=C13)[C@@]2(C)O InChI=1S/C40H46N2O17/c1-18-19(2)34(48)57-31-28(47)32(58-35(49)24-11-9-13-41-15-24)39(17-52-20(3)43)33(56-23(6)46)29(54-21(4)44)26-30(55-22(5)45)40(39,38(31,8)51)59-37(26,7)16-53-36(50)25-12-10-14-42-27(18)25/h9-15,18-19,26,28-33,47,51H,16-17H2,1-8H3/t18-,19+,26?,28+,29+,30+,31-,32+,33+,37+,38-,39+,40-/m0/s1 |
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Synonyms | Not Available |
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Chemical Formula | C40H46N2O17 |
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Average Mass | 826.8050 Da |
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Monoisotopic Mass | 826.27965 Da |
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IUPAC Name | (1S,3S,13S,14R,17S,18S,19S,20R,21S,22R,24R,25S)-21,22,24-tris(acetyloxy)-20-[(acetyloxy)methyl]-18,25-dihydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.0^{1,20}.0^{3,23}.0^{7,12}]pentacosa-7,9,11-trien-19-yl pyridine-3-carboxylate |
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Traditional Name | (1S,3S,13S,14R,17S,18S,19S,20R,21S,22R,24R,25S)-21,22,24-tris(acetyloxy)-20-[(acetyloxy)methyl]-18,25-dihydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.0^{1,20}.0^{3,23}.0^{7,12}]pentacosa-7,9,11-trien-19-yl pyridine-3-carboxylate |
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CAS Registry Number | Not Available |
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SMILES | C[C@H]1[C@@H](C)C(=O)O[C@H]2[C@@H](O)[C@@H](OC(=O)C3=CC=CN=C3)[C@]3(COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)C4[C@@H](OC(C)=O)[C@]3(O[C@]4(C)COC(=O)C3=CC=CN=C13)[C@@]2(C)O |
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InChI Identifier | InChI=1S/C40H46N2O17/c1-18-19(2)34(48)57-31-28(47)32(58-35(49)24-11-9-13-41-15-24)39(17-52-20(3)43)33(56-23(6)46)29(54-21(4)44)26-30(55-22(5)45)40(39,38(31,8)51)59-37(26,7)16-53-36(50)25-12-10-14-42-27(18)25/h9-15,18-19,26,28-33,47,51H,16-17H2,1-8H3/t18-,19+,26?,28+,29+,30+,31-,32+,33+,37+,38-,39+,40-/m0/s1 |
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InChI Key | JJUYPOGZDJZMIW-YURJKJQASA-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, H2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 100 MHz, H2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 252 MHz, H2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 1000 MHz, H2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 50 MHz, H2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 200 MHz, H2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 75 MHz, H2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 300 MHz, H2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 101 MHz, H2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 400 MHz, H2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 126 MHz, H2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 500 MHz, H2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 151 MHz, H2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 600 MHz, H2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 176 MHz, H2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 700 MHz, H2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 201 MHz, H2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 800 MHz, H2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 226 MHz, H2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 900 MHz, H2O, 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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