Record Information |
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Version | 1.0 |
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Created at | 2022-06-29 17:29:18 UTC |
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Updated at | 2022-06-29 17:29:18 UTC |
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NP-MRD ID | NP0138432 |
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Secondary Accession Numbers | None |
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Natural Product Identification |
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Common Name | 14alpha-hydroxy Paspalinine |
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Description | It was first documented in 2022 (PMID: 35850976). Based on a literature review very few articles have been published on methyl (2E)-2-[(2R,4S,5S)-5-ethenyl-12-methoxy-7,17-diazatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]Heptadeca-1(10),11(16),12,14-tetraen-4-yl]-3-methoxyprop-2-enoate (PMID: 35850964) (PMID: 35850957) (PMID: 35850911) (PMID: 35850908) (PMID: 35850884) (PMID: 35850883). |
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Structure | [H][C@]12C[C@@H]([C@@H](CN1CCC1=C2NC2=CC=CC(OC)=C12)C=C)C(=C/OC)\C(=O)OC InChI=1S/C23H28N2O4/c1-5-14-12-25-10-9-15-21-18(7-6-8-20(21)28-3)24-22(15)19(25)11-16(14)17(13-27-2)23(26)29-4/h5-8,13-14,16,19,24H,1,9-12H2,2-4H3/b17-13+/t14-,16+,19-/m1/s1 |
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Synonyms | Value | Source |
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Methyl (2E)-2-[(2R,4S,5S)-5-ethenyl-12-methoxy-7,17-diazatetracyclo[8.7.0.0,.0,]heptadeca-1(10),11(16),12,14-tetraen-4-yl]-3-methoxyprop-2-enoic acid | Generator |
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Chemical Formula | C27H31NO5 |
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Average Mass | 449.5470 Da |
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Monoisotopic Mass | 449.22022 Da |
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IUPAC Name | methyl (2E)-2-[(2S,3S,12bR)-3-ethenyl-8-methoxy-1H,2H,3H,4H,6H,7H,12H,12bH-indolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoate |
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Traditional Name | methyl (2E)-2-[(2S,3S,12bR)-3-ethenyl-8-methoxy-1H,2H,3H,4H,6H,7H,12H,12bH-indolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoate |
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CAS Registry Number | 151341-77-4 |
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SMILES | [H][C@]12CC3=C(NC4=C3C=CC=C4)[C@]1(C)[C@@]1(C)CC[C@@]34O[C@@]([H])(C(=O)C=C3[C@]1(O)[C@@H](O)C2)C(C)(C)O4 |
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InChI Identifier | InChI=1S/C27H31NO5/c1-23(2)22-18(29)13-19-26(32-22,33-23)10-9-24(3)25(4)14(12-20(30)27(19,24)31)11-16-15-7-5-6-8-17(15)28-21(16)25/h5-8,13-14,20,22,28,30-31H,9-12H2,1-4H3/t14-,20+,22+,24-,25-,26+,27+/m1/s1 |
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InChI Key | JNHPMJVSUJKCKH-KCCNSQSLSA-N |
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Experimental Spectra |
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| Not Available | 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 | - Bravi CA, Dell'Oglio P, Mazzone E, Moschovas MC, Falagario U, Piazza P, Scarcella S, Bednarz C, Sarchi L, Tappero S, Knipper S, De Groote R, Sjoberg D, Schiavina R, Suardi N, Terrone C, Autorino R, Carrieri G, Galosi A, Galfano A, Briganti A, Montorsi F, Patel V, Vickers A, Mottrie A: The Surgical Learning Curve for Biochemical Recurrence After Robot-assisted Radical Prostatectomy. Eur Urol Oncol. 2022 Jul 15. pii: S2588-9311(22)00113-4. doi: 10.1016/j.euo.2022.06.010. [PubMed:35850976 ]
- Lona-Reyes JC, Gomez-Ruiz LM, Cordero-Zamora A, Cortes-Gonzalez SI, Quiles-Corona M, Perez-Ramirez RO, Pinto-Macedo H: Incidence and factors associated with invasive candidiasis in a neonatal intensive care unit in Mexico. An Pediatr (Engl Ed). 2022 Aug;97(2):79-86. doi: 10.1016/j.anpede.2021.07.008. Epub 2022 Jul 15. [PubMed:35850964 ]
- van Ede ES, Scheerhoorn J, Bonomi AG, Buise MP, Bouwman RA, Nienhuijs SW: Continuous remote monitoring in post-bariatric surgery patients: development of an early warning protocol. Surg Obes Relat Dis. 2022 Jun 21. pii: S1550-7289(22)00284-2. doi: 10.1016/j.soard.2022.06.018. [PubMed:35850957 ]
- Hilser JR, Hartiala JA, Sriprasert I, Kono N, Cai Z, Karim R, DeYoung J, Mack WJ, Hodis HN, Allayee H: Effect of menopausal hormone therapy on methylation levels in early and late postmenopausal women. Clin Epigenetics. 2022 Jul 18;14(1):90. doi: 10.1186/s13148-022-01311-w. [PubMed:35850911 ]
- Zhou G, Zheng J, Chen Z, Hu D, Li S, Zhuang W, He Z, Lin G, Wu B, Zhang W, Fang W, Zheng F, Wang J, Chen G, Chen M: Clinical significance of tumor-infiltrating lymphocytes investigated using routine H&E slides in small cell lung cancer. Radiat Oncol. 2022 Jul 18;17(1):127. doi: 10.1186/s13014-022-02098-z. [PubMed:35850908 ]
- Sugino P, Meneghim RLFS, Schellini SA: Comparison of two techniques for surgical eyebrow suspension. J Fr Ophtalmol. 2022 Sep;45(7):741-747. doi: 10.1016/j.jfo.2022.03.011. Epub 2022 Jul 16. [PubMed:35850884 ]
- Kallel Z, Maalej A, Fourati H, Khallouli A, Rannen R: [Forensic assessment of eye blasts in active military personal]. J Fr Ophtalmol. 2022 Oct;45(8):928-936. doi: 10.1016/j.jfo.2022.04.011. Epub 2022 Jul 16. [PubMed:35850883 ]
- Myagmar G, Daher R, Yeo IL, Ahn JS, Han JS, Lee JH: Color and surface stainability of additively and subtractively manufactured interim restorative materials against mouth rinses. J Prosthet Dent. 2022 Jul 15. pii: S0022-3913(22)00376-6. doi: 10.1016/j.prosdent.2022.06.003. [PubMed:35850874 ]
- Zeng HT, Dai D, He XQ, Tian YY, Wang XQ, Yu JB, Li J, Liao WB: [Research practice and strategy of resource utilization of residues for edible medicinal plants under background of Big Health]. Zhongguo Zhong Yao Za Zhi. 2022 Jul;47(14):3968-3976. doi: 10.19540/j.cnki.cjcmm.20220316.103. [PubMed:35850857 ]
- Liu CQ, Ren Y, Zhang YL: [Research status and strategy of quality control of medicinal and edible food]. Zhongguo Zhong Yao Za Zhi. 2022 Jul;47(14):3963-3967. doi: 10.19540/j.cnki.cjcmm.20220322.601. [PubMed:35850856 ]
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