Record Information |
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Version | 2.0 |
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Created at | 2023-01-16 20:00:34 UTC |
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Updated at | 2024-09-03 04:15:48 UTC |
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NP-MRD ID | NP0331460 |
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Natural Product DOI | https://doi.org/10.57994/0411 |
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Secondary Accession Numbers | None |
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Natural Product Identification |
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Common Name | Baccaramione C |
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Description | Baccaramione C was first documented in 2023 (PMID: 36516399). Based on a literature review very few articles have been published on Baccaramione C. |
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Structure | |
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Synonyms | Not Available |
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Chemical Formula | C19H22O4 |
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Average Mass | 314.3810 Da |
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Monoisotopic Mass | 314.15181 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 | Not Available |
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InChI Identifier | InChI=1S/C19H22O4/c1-18(2)15(20)7-6-13-12-10-14(22-4)16(21)17(23-5)11(12)8-9-19(13,18)3/h6-10,13,21H,1-5H3/t13-,19+/m0/s1 |
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InChI Key | RRYILQPHSOGAPK-ORAYPTAESA-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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NOESY NMR | [1H, 1H] NMR Spectrum (2D, 500 MHz, CDCl3, experimental) | zbbrush@simm.ac.cn | Not Available | Not Available | 2024-05-11 | View Spectrum | HMBC NMR | [1H, 13C] NMR Spectrum (2D, 600 MHz, CDCl3, experimental) | zbbrush@simm.ac.cn | Not Available | Not Available | 2024-05-11 | View Spectrum | HSQC NMR | [1H, 13C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental) | zbbrush@simm.ac.cn | Not Available | Not Available | 2024-05-11 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 500 MHz, CDCl3, experimental) | zbbrush@simm.ac.cn | Not Available | Not Available | 2024-05-11 | View Spectrum | 1D_DEPT NMR | 13C NMR Spectrum (1D, 126 MHz, CDCl3, experimental) | zbbrush@simm.ac.cn | Not Available | Not Available | 2024-05-11 | View Spectrum | COSY NMR | [1H, 1H] NMR Spectrum (2D, 500 MHz, CDCl3, experimental) | zbbrush@simm.ac.cn | Not Available | Not Available | 2024-05-11 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 126 MHz, CDCl3, experimental) | zbbrush@simm.ac.cn | Not Available | Not Available | 2024-05-11 | View Spectrum |
| Predicted Spectra |
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| Not Available | Chemical Shift Submissions |
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| Not Available | Species |
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Species of Origin | Species Name | Source | Reference |
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ramiflora | | |
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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 | Not Available |
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External Links |
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HMDB ID | Not Available |
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DrugBank ID | Not Available |
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Phenol Explorer Compound ID | Not Available |
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FoodDB ID | Not Available |
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KNApSAcK ID | Not Available |
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Chemspider ID | Not Available |
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KEGG Compound ID | Not Available |
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BioCyc ID | Not Available |
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BiGG ID | Not Available |
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Wikipedia Link | Not Available |
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METLIN ID | Not Available |
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PubChem Compound | Not Available |
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PDB ID | Not Available |
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ChEBI ID | Not Available |
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Good Scents ID | Not Available |
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References |
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General References | - Chen SS, Tong X, Liu XY, Zheng CY, Zhou JS, Fan YY, He SJ, Zhou B, Yue JM: Baccaramiones A-D, Four Highly Oxygenated and Rearranged Trinorditerpenoids from Baccaurea ramiflora. J Org Chem. 2023 Jan 6;88(1):455-461. doi: 10.1021/acs.joc.2c02442. Epub 2022 Dec 14. [PubMed:36516399 ]
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