Record Information |
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Version | 1.0 |
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Created at | 2024-04-20 01:35:59 UTC |
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Updated at | 2024-04-20 02:29:37 UTC |
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NP-MRD ID | NP0332793 |
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Secondary Accession Numbers | None |
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Natural Product Identification |
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Common Name | Levinoid A |
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Description | Not Available |
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Structure | [H][C@]12C=C(CC[C@@]1([H])C(C)=CC[C@H]2C(C)C)C(O)=O InChI=1S/C15H22O2/c1-9(2)12-6-4-10(3)13-7-5-11(15(16)17)8-14(12)13/h4,8-9,12-14H,5-7H2,1-3H3,(H,16,17)/t12-,13-,14+/m0/s1 |
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Synonyms | Not Available |
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Chemical Formula | C15H22O2 |
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Average Mass | 234.3390 Da |
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Monoisotopic Mass | 234.16198 Da |
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IUPAC Name | Not Available |
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Traditional Name | Not Available |
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CAS Registry Number | Not Available |
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SMILES | [H][C@]12C=C(CC[C@@]1([H])C(C)=CC[C@H]2C(C)C)C(O)=O |
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InChI Identifier | InChI=1S/C15H22O2/c1-9(2)12-6-4-10(3)13-7-5-11(15(16)17)8-14(12)13/h4,8-9,12-14H,5-7H2,1-3H3,(H,16,17)/t12-,13-,14+/m0/s1 |
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InChI Key | CYUIZQOQFRZDTB-MELADBBJSA-N |
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Experimental Spectra |
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| Spectrum Type | Description | Depositor Email | Depositor Organization | Depositor | Deposition Date | View |
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HMBC NMR | [1H, 13C] NMR Spectrum (2D, 151 MHz, CDCL3, experimental) | tangjianwei@ust.hk | The Hong Kong University of Science and Technology (HKUST) | Tang Jianwei | 2024-04-20 | View Spectrum | HSQC NMR | [1H, 13C] NMR Spectrum (2D, 151 MHz, CDCL3, experimental) | tangjianwei@ust.hk | The Hong Kong University of Science and Technology (HKUST) | Tang Jianwei | 2024-04-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 151 MHz, CDCL3, experimental) | tangjianwei@ust.hk | The Hong Kong University of Science and Technology (HKUST) | Tang Jianwei | 2024-04-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 151 MHz, CDCL3, experimental) | tangjianwei@ust.hk | The Hong Kong University of Science and Technology (HKUST) | Tang Jianwei | 2024-04-20 | View Spectrum | COSY NMR | [1H, 1H] NMR Spectrum (2D, 799 MHz, CDCL3, experimental) | tangjianwei@ust.hk | The Hong Kong University of Science and Technology (HKUST) | Tang Jianwei | 2024-04-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 600 MHz, CDCL3, experimental) | tangjianwei@ust.hk | The Hong Kong University of Science and Technology (HKUST) | Tang Jianwei | 2024-04-20 | View Spectrum | ROESY NMR | [1H, 1H] NMR Spectrum (2D, 500 MHz, CDCL3, experimental) | tangjianwei@ust.hk | The Hong Kong University of Science and Technology (HKUST) | Tang Jianwei | 2024-04-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 151 MHz, CDCL3, experimental) | tangjianwei@ust.hk | The Hong Kong University of Science and Technology (HKUST) | Tang Jianwei | 2024-04-20 | View Spectrum |
| Predicted Spectra |
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| Not Available | Chemical Shift Submissions |
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| Spectrum Type | Description | Depositor ID | Depositor Organization | Depositor | Deposition Date | View |
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1D NMR | 1H NMR Spectrum (1D, 600.172304604, CDCl3, simulated) | Tangjianwei | The Hong Kong University of Science and Technology (HKUST) | Tang Jianwei | 2024-04-20 | View Spectrum |
| 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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