Record Information |
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Version | 1.0 |
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Created at | 2023-06-08 16:08:03 UTC |
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Updated at | 2024-04-19 09:48:28 UTC |
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NP-MRD ID | NP0331675 |
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Secondary Accession Numbers | None |
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Natural Product Identification |
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Common Name | 3-hydroxyurs-12-en-27-oic 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,10S,12aR)-10-hydroxy-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) (PMID: 37288645) (PMID: 37288644). |
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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)C5CC[C@@]34C)C2[C@H]1C InChI=1S/C30H48O3/c1-18-10-13-27(5)16-17-30(25(32)33)20(24(27)19(18)2)8-9-22-28(6)14-12-23(31)26(3,4)21(28)11-15-29(22,30)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)/t18-,19+,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,10S,12ar)-10-hydroxy-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 | C30H48O3 |
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Average Mass | 456.7110 Da |
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Monoisotopic Mass | 456.36035 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)C5CC[C@@]34C)C2[C@H]1C |
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InChI Identifier | InChI=1S/C30H48O3/c1-18-10-13-27(5)16-17-30(25(32)33)20(24(27)19(18)2)8-9-22-28(6)14-12-23(31)26(3,4)21(28)11-15-29(22,30)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21?,22?,23+,24?,27-,28+,29-,30-/m1/s1 |
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InChI Key | RXVRYAUOTRSYDU-MQMMJGENSA-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 (2D, 600 MHz, CDCl3, experimental) | zxliao@seu.edu.cn | Not Available | Not Available | 2023-06-08 | View Spectrum | 1D NMR | [13C, ] NMR Spectrum (2D, 151 MHz, CDCl3, experimental) | zxliao@seu.edu.cn | Not Available | Not Available | 2023-06-08 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 150.917898807 MHz, CDCl3, simulated) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 600.133705802 MHz, CDCl3, simulated) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | 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 | Not Available |
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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 ]
- Martin N, Robinson TB, Clusella-Trullas S: Warmer and more acidic conditions enhance performance of an endemic low-shore gastropod. J Exp Biol. 2023 Jun 1;226(11):jeb245423. doi: 10.1242/jeb.245423. Epub 2023 Jun 7. [PubMed:37288645 ]
- Wang H: [Exploration of Centralized Purchasing Management Platform for Research Reagent Supplies Based on One-stop Service]. Zhongguo Yi Liao Qi Xie Za Zhi. 2023 May 30;47(3):351-354. doi: 10.3969/j.issn.1671-7104.2023.03.025. [PubMed:37288644 ]
- Liu B, Gu W: [Research on Life Cycle Management of Medical Consumables Based on Hospital Resource Planning System]. Zhongguo Yi Liao Qi Xie Za Zhi. 2023 May 30;47(3):346-350. doi: 10.3969/j.issn.1671-7104.2023.03.024. [PubMed:37288643 ]
- Dong C, Tang G, Zhou Q: [Research on Management Efficiency of Hospital Low-value Consumables in Nursing Unit under Lean Management Mode]. Zhongguo Yi Liao Qi Xie Za Zhi. 2023 May 30;47(3):341-345. doi: 10.3969/j.issn.1671-7104.2023.03.023. [PubMed:37288642 ]
- Wu L, Zhou R: [Information Construction of Hospital Medical Consumables Management Based on SPD Mode]. Zhongguo Yi Liao Qi Xie Za Zhi. 2023 May 30;47(3):337-340. doi: 10.3969/j.issn.1671-7104.2023.03.022. [PubMed:37288641 ]
- Chen Z, Liu Z, Hao L, Fu B: [Study on Analytical Method of Leachable Substances of Allogeneic Products]. Zhongguo Yi Liao Qi Xie Za Zhi. 2023 May 30;47(3):332-336. doi: 10.3969/j.issn.1671-7104.2023.03.021. [PubMed:37288640 ]
- Tian H, Wu S, Liang Y, Wang W, Ji C: [A Brief Analysis of Equivalence Demonstration Techniques for Clinical Evaluation of Medical Devices]. Zhongguo Yi Liao Qi Xie Za Zhi. 2023 May 30;47(3):328-331. doi: 10.3969/j.issn.1671-7104.2023.03.020. [PubMed:37288639 ]
- He T, Chu S, Xie J: [A Brief Discussion on the in Vitro Diagnostic Reagent Inspection Practice of Self-examination Management Regulations for Medical Device Registration]. Zhongguo Yi Liao Qi Xie Za Zhi. 2023 May 30;47(3):324-327. doi: 10.3969/j.issn.1671-7104.2023.03.019. [PubMed:37288638 ]
- Chu S: [Discussion on Key Control Points and Common Problems of Molecular Diagnostic Reagents in the Process of Design and Development]. Zhongguo Yi Liao Qi Xie Za Zhi. 2023 May 30;47(3):320-323. doi: 10.3969/j.issn.1671-7104.2023.03.018. [PubMed:37288637 ]
- Luo Q, Li J, Xu H, Wang W: [Concerns of Technical Evaluation on Registration of Disposable Endoscopic Injection Needle]. Zhongguo Yi Liao Qi Xie Za Zhi. 2023 May 30;47(3):317-319. doi: 10.3969/j.issn.1671-7104.2023.03.017. [PubMed:37288636 ]
- Wu J, Jin L, Dong L, Han D, Shi X: [Analysis of Revision Content and Evaluation Attentions on Guidance for Registration of Metallic Bone Plate Internal Fixation System (Revised in 2021)]. Zhongguo Yi Liao Qi Xie Za Zhi. 2023 May 30;47(3):312-316. doi: 10.3969/j.issn.1671-7104.2023.03.016. [PubMed:37288635 ]
- Liu F, Chen H, Chai Q, Yang S, Wang X, Liu S, Zhang Y, Dong D: [Discussion on the Authenticity Verification Method in the Verification of Medical Device Registration Quality Management System]. Zhongguo Yi Liao Qi Xie Za Zhi. 2023 May 30;47(3):309-311. doi: 10.3969/j.issn.1671-7104.2023.03.015. [PubMed:37288634 ]
- Su T, Deng C, Li X: [Roadmap of Medical Device for Implanted Brain-computer Interface]. Zhongguo Yi Liao Qi Xie Za Zhi. 2023 May 30;47(3):304-308. doi: 10.3969/j.issn.1671-7104.2023.03.014. [PubMed:37288633 ]
- Huang T, Zou Q, Chu Y, Zheng K, Wang Z: [Application Status and Prospect of Rehabilitation Assessment Technology]. Zhongguo Yi Liao Qi Xie Za Zhi. 2023 May 30;47(3):298-303. doi: 10.3969/j.issn.1671-7104.2023.03.013. [PubMed:37288632 ]
- Niu H, Zhu Z, Hu D, Ma S, Li R, Yuan S, Ye J, Jin H: [Research and Development Trend of Medical Oxygen Production Equipment]. Zhongguo Yi Liao Qi Xie Za Zhi. 2023 May 30;47(3):294-297. doi: 10.3969/j.issn.1671-7104.2023.03.012. [PubMed:37288631 ]
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