| Record Information |
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| Version | 2.0 |
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| Created at | 2024-06-06 03:49:59 UTC |
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| Updated at | 2025-06-10 23:41:08 UTC |
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| NP-MRD ID | NP0333380 |
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| Natural Product DOI | https://doi.org/10.57994/2758 |
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| Secondary Accession Numbers | None |
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| Natural Product Identification |
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| Common Name | 4-Methylsulfinyl-9H-carbazol-3-ol |
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| Description | 4-Methylsulfinyl-9H-carbazol-3-ol belongs to the class of organic compounds known as carbazoles. Carbazoles are compounds containing a three ring system containing a pyrrole ring fused on either side to a benzene ring. Based on a literature review very few articles have been published on 4-Methylsulfinyl-9H-carbazol-3-ol. |
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| Structure | CS(=O)C1=C(O)C=CC2=C1C1=CC=CC=C1N2 InChI=1/C13H11NO2S/c1-17(16)13-11(15)7-6-10-12(13)8-4-2-3-5-9(8)14-10/h2-7,14-15H,1H3 |
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| Synonyms | | Value | Source |
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| 4-Methylsulphinyl-9H-carbazol-3-ol | Generator |
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| Chemical Formula | C13H11NO2S |
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| Average Mass | 245.3000 Da |
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| Monoisotopic Mass | 245.05105 Da |
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| IUPAC Name | 4-methanesulfinyl-9H-carbazol-3-ol |
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| Traditional Name | 4-methanesulfinyl-9H-carbazol-3-ol |
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| CAS Registry Number | Not Available |
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| SMILES | CS(=O)C1=C(O)C=CC2=C1C1=CC=CC=C1N2 |
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| InChI Identifier | InChI=1/C13H11NO2S/c1-17(16)13-11(15)7-6-10-12(13)8-4-2-3-5-9(8)14-10/h2-7,14-15H,1H3 |
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| InChI Key | VMEVAWVYZCHGQY-UHFFFAOYNA-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 | 13C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental) | 17854207085@163.com | Ocean university of China | Yan Pengcheng | 2024-06-06 | View Spectrum |
| | Predicted Spectra |
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| Not Available | | Chemical Shift Submissions |
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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, C2D6OS, simulated) | 17854207085@163.com | Ocean university of China | Yan Pengcheng | 2024-06-06 | View Spectrum |
| | Species |
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| Species of Origin | | Species Name | Source | Reference |
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| Moorena sp. | | |
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| Chemical Taxonomy |
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| Description | This compound belongs to the class of organic compounds known as carbazoles. These are compounds containing a three ring system containing a pyrrole ring fused on either side to a benzene 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 | Carbazoles |
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| Direct Parent | Carbazoles |
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| Alternative Parents | |
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| Substituents | - Carbazole
- Indole
- 1-hydroxy-2-unsubstituted benzenoid
- Benzenoid
- Heteroaromatic compound
- Pyrroline
- Pyrrole
- Sulfoxide
- Azacycle
- Secondary amine
- Secondary aliphatic amine
- Organic nitrogen compound
- Organic oxygen compound
- Organopnictogen compound
- Organic oxide
- Hydrocarbon derivative
- Organosulfur compound
- Organooxygen compound
- Organonitrogen compound
- Amine
- Aromatic heteropolycyclic compound
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| Molecular Framework | Aromatic 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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