Record Information |
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Version | 1.0 |
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Created at | 2022-12-22 09:20:48 UTC |
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Updated at | 2024-04-19 09:35:57 UTC |
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NP-MRD ID | NP0331294 |
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Secondary Accession Numbers | None |
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Natural Product Identification |
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Common Name | Dysidealactam C |
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Description | CHEMBL4643242 belongs to the class of organic compounds known as indolyl carboxylic acids and derivatives. Indolyl carboxylic acids and derivatives are compounds containing a carboxylic acid chain (of at least 2 carbon atoms) linked to an indole ring. It was first documented in 2023 (PMID: 37078450). Based on a literature review a significant number of articles have been published on CHEMBL4643242 (PMID: 37078444) (PMID: 37078443) (PMID: 37078154) (PMID: 37078114) (PMID: 37079959) (PMID: 37079958). |
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Structure | [H][C@@]12CCC3=C([C@@H](O)N(CC(O)=O)C3=O)[C@@]1(C)CCCC2(C)C InChI=1S/C17H25NO4/c1-16(2)7-4-8-17(3)11(16)6-5-10-13(17)15(22)18(14(10)21)9-12(19)20/h11,15,22H,4-9H2,1-3H3,(H,19,20)/t11-,15+,17-/m0/s1 |
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Synonyms | Not Available |
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Chemical Formula | C17H25NO4 |
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Average Mass | 307.3900 Da |
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Monoisotopic Mass | 307.17836 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@@]12CCC3=C([C@@H](O)N(CC(O)=O)C3=O)[C@@]1(C)CCCC2(C)C |
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InChI Identifier | InChI=1S/C17H25NO4/c1-16(2)7-4-8-17(3)11(16)6-5-10-13(17)15(22)18(14(10)21)9-12(19)20/h11,15,22H,4-9H2,1-3H3,(H,19,20)/t11-,15+,17-/m0/s1 |
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InChI Key | AOALSOLHBFZMHD-CXMBCZLWSA-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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ROESY NMR | [1H, 1H] NMR Spectrum (2D, 600 MHz, CD3OD, experimental) | r.capon@imb.uq.edu.au | Not Available | Not Available | 2022-12-22 | View Spectrum | 1D NMR | [13C, ] NMR Spectrum (2D, 151 MHz, CD3OD, experimental) | r.capon@imb.uq.edu.au | Not Available | Not Available | 2022-12-22 | View Spectrum | COSY NMR | [1H, 1H] NMR Spectrum (2D, 600 MHz, CD3OD, experimental) | r.capon@imb.uq.edu.au | Not Available | Not Available | 2022-12-22 | View Spectrum | HMBC NMR | [1H, 13C] NMR Spectrum (2D, 600 MHz, CD3OD, experimental) | r.capon@imb.uq.edu.au | Not Available | Not Available | 2022-12-22 | View Spectrum | HSQC NMR | [1H, 13C] NMR Spectrum (2D, 600 MHz, CD3OD, experimental) | r.capon@imb.uq.edu.au | Not Available | Not Available | 2022-12-22 | View Spectrum | 1D NMR | [1H, ] NMR Spectrum (2D, 600 MHz, CD3OD, experimental) | r.capon@imb.uq.edu.au | Not Available | Not Available | 2022-12-22 | View Spectrum | 1D NMR | [1H, ] NMR Spectrum (2D, 600 MHz, CD3OD, experimental) | r.capon@imb.uq.edu.au | Not Available | Not Available | 2022-12-22 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 600.08 MHz, CD3OD, simulated) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 600.08 MHz, CD3OD, simulated) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 150.91 MHz, CD3OD, 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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Description | Belongs to the class of organic compounds known as indolyl carboxylic acids and derivatives. Indolyl carboxylic acids and derivatives are compounds containing a carboxylic acid chain (of at least 2 carbon atoms) linked to an indole ring. |
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Kingdom | Organic compounds |
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Super Class | Organoheterocyclic compounds |
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Class | Indoles and derivatives |
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Sub Class | Indolyl carboxylic acids and derivatives |
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Direct Parent | Indolyl carboxylic acids and derivatives |
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Alternative Parents | |
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Substituents | - Indolyl carboxylic acid derivative
- Isoindolone
- Alpha-amino acid or derivatives
- Isoindole or derivatives
- Isoindole
- Indole
- Tertiary carboxylic acid amide
- Pyrroline
- Lactam
- Carboxamide group
- Azacycle
- Monocarboxylic acid or derivatives
- Carboxylic acid
- Carboxylic acid derivative
- Alkanolamine
- Organic nitrogen compound
- Organic oxygen compound
- Organopnictogen compound
- Organic oxide
- Hydrocarbon derivative
- Organooxygen compound
- Organonitrogen compound
- Carbonyl group
- Aliphatic heteropolycyclic compound
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Molecular Framework | Aliphatic heteropolycyclic compounds |
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External Descriptors | Not Available |
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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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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 | 83286999 |
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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 | 156017446 |
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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 | - Russi AE, Shivakumar P, Luo Z, Bezerra J: Plasticity between ILC2 subsets and amphiregulin expression regulate epithelial repair in biliary atresia. Hepatology. 2023 Apr 21. doi: 10.1097/HEP.0000000000000418. [PubMed:37078450 ]
- Hlady RA, Robertson KD: Epigenetic memory of environmental exposures as a mediator of liver disease. Hepatology. 2023 Apr 21. doi: 10.1097/HEP.0000000000000414. [PubMed:37078444 ]
- Ufere NN: Home is where the liver is?: moving beyond readmissions to time at home as a patient-centered and pragmatic quality measure in cirrhosis care. Hepatology. 2023 Apr 21. doi: 10.1097/HEP.0000000000000415. [PubMed:37078443 ]
- Arnon R, Rubinov A: [[PTOSIS AS A SIGN OF A SYSTEMIC DISEASE]]. Harefuah. 2023 Feb;162(2):119-121. [PubMed:37078154 ]
- Shemesh N, Olshaker H: [[A MULTICENTER SPANISH STUDY OF ATROPINE 0.01% IN CHILDHOOD MYOPIA PROGRESSION]]. Harefuah. 2023 Feb;162(2):116-118. [PubMed:37078114 ]
- Gonzalez Muriel RM, Garcia Rabanal D, Ramos Pascua LR: [Incidental finding in mechanical gonalgia in a patient with a history of breast cancer]. Semergen. 2023 Jul-Aug;49(5):101978. doi: 10.1016/j.semerg.2023.101978. Epub 2023 Apr 18. [PubMed:37079959 ]
- Vallina Perez JL, Taule Sanchez M, Miguel Fernandez V, Iglesias Aranda Catalan P: [<>]. Semergen. 2023 Jul-Aug;49(5):101974. doi: 10.1016/j.semerg.2023.101974. Epub 2023 Apr 18. [PubMed:37079958 ]
- Samboni-Mendez M, Benavides-Ruiz MM, Piamba-Valencia AM, Sanchez-Duque JA: [Subcutaneous analgesia in elderly palliative home care]. Semergen. 2023 Jul-Aug;49(5):101975. doi: 10.1016/j.semerg.2023.101975. Epub 2023 Apr 18. [PubMed:37079957 ]
- K B C, R H, R A, G JJB, J P D, Banjara SK, M A, K PR, B N, M SP: Macronutrient composition of term and preterm human milk of different socio economic groups. Prostaglandins Leukot Essent Fatty Acids. 2023 May;192:102571. doi: 10.1016/j.plefa.2023.102571. Epub 2023 Mar 30. [PubMed:37079956 ]
- Jyothi VGSS, Veerabomma H, Tryphena KP, Khatri DK, Singh SB, Madan J: Acute and sub-acute dermal toxicity of meloxicam emulgel: Analysis of biochemical, hematological, histopathological and immunohistochemical expression. Biochem Biophys Res Commun. 2023 Jun 11;660:88-95. doi: 10.1016/j.bbrc.2023.04.001. Epub 2023 Apr 11. [PubMed:37079955 ]
- Akhlaghpour H: Erratum to "An RNA-based theory of natural universal computation" [J. Theor. Biol. 537 (2022) 110984]. J Theor Biol. 2023 Jun 7;566:111481. doi: 10.1016/j.jtbi.2023.111481. Epub 2023 Apr 18. [PubMed:37079954 ]
- Pelletier F, Torres A, Meloche-Dumas L, Guerard-Poirier N, Kaviani A, Kapralos B, Mercier F, Dubrowski A, Patocskai E: The Role of Collaborative Observational Practice and Feedback-Discourse to Promote Remote Acquisition of Technical Surgical Skills. J Surg Res. 2023 Aug;288:372-382. doi: 10.1016/j.jss.2023.02.006. Epub 2023 Apr 18. [PubMed:37079953 ]
- Hryciuk MM, Schroter F, Hennicke L, Braun BC: Spheroid formation and luteinization of granulosa cells of felids in a long-term 3D culture. Differentiation. 2023 May-Jun;131:38-48. doi: 10.1016/j.diff.2023.03.002. Epub 2023 Apr 6. [PubMed:37079952 ]
- Chan NY, Wu WJ, Chan JWY, Chan KCC, Li AM, Chan SSM, Hau KT, Wing YK: Sleep and academic performance among students in Hong Kong: Curvilinear relationship suggesting an optimal amount of sleep. Sleep Med. 2023 Jun;106:97-105. doi: 10.1016/j.sleep.2023.04.001. Epub 2023 Apr 6. [PubMed:37079951 ]
- Toss A, Moscetti L: Are you treating ypN0 patient with adjuvant abemaciclib? ESMO Open. 2023 Jun;8(3):101217. doi: 10.1016/j.esmoop.2023.101217. Epub 2023 Apr 19. [PubMed:37079950 ]
- Gracia-Sanchez A, Lopez-Pineda A, Lazaro-Martinez JL, Perez A, Pomares-Gomez FJ, Fernandez-Seguin LM, Gil-Guillen VF, Chicharro-Luna E: Consensus-based recommendations on physical activity and exercise in patients with diabetes at risk of foot ulcerations: a Delphi study. Braz J Phys Ther. 2023 Mar-Apr;27(2):100500. doi: 10.1016/j.bjpt.2023.100500. Epub 2023 Apr 6. [PubMed:37079949 ]
- Tabata F, Wada Y, Shibasaki T, Kawakami S, Inubashiri M, Hosaka M, Noshiro K, Umazume T, Miyaji K: A lower ratio of reduced to total albumin in serum is associated with protein nutritional status of pregnant women in Japan. Nutr Res. 2023 Jun;114:1-12. doi: 10.1016/j.nutres.2023.03.006. Epub 2023 Mar 23. [PubMed:37079948 ]
- Dean B, Haroutunian V, Scarr E: Lower levels of cortical [(3)H]pirenzepine binding to postmortem tissue defines a sub-group of older people with schizophrenia with less severe cognitive deficits. Schizophr Res. 2023 May;255:274-282. doi: 10.1016/j.schres.2023.03.035. Epub 2023 Apr 19. [PubMed:37079947 ]
- Buma S, Banks L, Onwuka A, Althubaiti A, Wiet G: Maternal infant bonding in tracheostomy dependent infants: A cross sectional study. Int J Pediatr Otorhinolaryngol. 2023 May;168:111549. doi: 10.1016/j.ijporl.2023.111549. Epub 2023 Apr 7. [PubMed:37079946 ]
- Hintze JM, Afshar S, Taghinia A, Labow B, Green M, Robson CD, Marcus K, Mack J, Perez-Atayde A, Rahbar R: A multi-disciplinary team approach to pediatric malignant mandibular tumors. Int J Pediatr Otorhinolaryngol. 2023 May;168:111547. doi: 10.1016/j.ijporl.2023.111547. Epub 2023 Apr 15. [PubMed:37079945 ]
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