Record Information |
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Version | 1.0 |
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Created at | 2023-06-08 16:11:17 UTC |
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Updated at | 2024-05-13 01:10:33 UTC |
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NP-MRD ID | NP0331678 |
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Secondary Accession Numbers | None |
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Natural Product Identification |
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Common Name | Astilbotriterpenic acid |
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Description | It was first documented in 2023 (PMID: 37288650). Based on a literature review a significant number of articles have been published on (1S,2R,4aR,6aR,6bR,8R,10S,12aR)-8,10-dihydroxy-1,2,4a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-6a-carboxylic acid (PMID: 37288649) (PMID: 37288648) (PMID: 37288647) (PMID: 37288646). |
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Structure | C[C@@H]1CC[C@]2(C)CC[C@]3(C(O)=O)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5[C@H](O)C[C@@]34C)C2[C@H]1C InChI=1S/C30H48O4/c1-17-10-12-27(5)14-15-30(25(33)34)19(23(27)18(17)2)8-9-21-28(6)13-11-22(32)26(3,4)24(28)20(31)16-29(21,30)7/h8,17-18,20-24,31-32H,9-16H2,1-7H3,(H,33,34)/t17-,18+,20-,21?,22+,23?,24?,27-,28-,29-,30-/m1/s1 |
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Synonyms | Value | Source |
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(1S,2R,4AR,6ar,6BR,8R,10S,12ar)-8,10-dihydroxy-1,2,4a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-6a-carboxylate | Generator |
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Chemical Formula | C30H48O4 |
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Average Mass | 472.7100 Da |
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Monoisotopic Mass | 472.35526 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 | C[C@@H]1CC[C@]2(C)CC[C@]3(C(O)=O)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5[C@H](O)C[C@@]34C)C2[C@H]1C |
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InChI Identifier | InChI=1S/C30H48O4/c1-17-10-12-27(5)14-15-30(25(33)34)19(23(27)18(17)2)8-9-21-28(6)13-11-22(32)26(3,4)24(28)20(31)16-29(21,30)7/h8,17-18,20-24,31-32H,9-16H2,1-7H3,(H,33,34)/t17-,18+,20-,21?,22+,23?,24?,27-,28-,29-,30-/m1/s1 |
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InChI Key | VHQIDEPOCDVTLV-OFEZYMBQSA-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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1D NMR | 1H NMR Spectrum (1D, 400 MHz, C2D6OS, experimental) | zxliao@seu.edu.cn | Not Available | Not Available | 2024-05-11 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 101 MHz, C2D6OS, experimental) | zxliao@seu.edu.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 | |
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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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General References | - Song G, Trujillo S, Fu Y, Shibi F, Chen J, Fass R: Transcutaneous electrical stimulation for gastrointestinal motility disorders. Neurogastroenterol Motil. 2023 Jun 8:e14618. doi: 10.1111/nmo.14618. [PubMed:37288650 ]
- Perry WB: Dining amidst the decibels is not an issue when you have company: anthropogenic noise and the topmouth Gudgeon. J Fish Biol. 2023 Jun;102(6):1271. doi: 10.1111/jfb.15459. [PubMed:37288649 ]
- Pansomsuay R, Duangupama T, Pittayakhajonwut P, Intaraudom C, Suriyachadkun C, He YW, Tanasupawat S, Thawai C: Streptomyces zingiberis sp. nov., an endophytic actinobacterium isolated from the root tissue of Zingiber montanum. Int J Syst Evol Microbiol. 2023 Jun;73(6). doi: 10.1099/ijsem.0.005765. [PubMed:37288648 ]
- Meng W, Qiao K, Liu F, Gao X, Hu X, Liu J, Gao Y, Zhu J: Construction and application of a new CRISPR/Cas12a system in Stenotrophomonas AGS-1 from aerobic granular sludge. Biotechnol J. 2023 Jun 8:e2200596. doi: 10.1002/biot.202200596. [PubMed:37288647 ]
- Rodgers EM, Gomez Isaza DF: The mechanistic basis and adaptive significance of cross-tolerance: a 'pre-adaptation' to a changing world? J Exp Biol. 2023 Jun 1;226(11):jeb245644. doi: 10.1242/jeb.245644. Epub 2023 Jun 8. [PubMed:37288646 ]
- Shao Y, Li Q, Wang M, Wang C, Zhang Y, Xu C, Liao Z, Han H: Triterpenoid acids characterized by the oxidation of the C-27-methy from the roots of Astilbe grandis Stapf ex Wils. Fitoterapia. 2023 Jul;168:105556. doi: 10.1016/j.fitote.2023.105556. Epub 2023 May 30. [PubMed:37263444 ]
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