| Record Information |
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| Version | 2.0 |
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| Created at | 2022-03-17 20:54:09 UTC |
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| Updated at | 2022-03-17 20:54:09 UTC |
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| NP-MRD ID | NP0048293 |
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| Secondary Accession Numbers | None |
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| Natural Product Identification |
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| Common Name | Lucidenic acid J |
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| Description | Corosin, also known as capsularone or vismiaefolic acid, belongs to the class of organic compounds known as triterpenoids. These are terpene molecules containing six isoprene units. Corosin is an extremely weak basic (essentially neutral) compound (based on its pKa). Outside of the human body, Corosin has been detected, but not quantified in, a few different foods, such as green vegetables, herbs and spices, and tea. Lucidenic acid J is found in Ganoderma lucidum . This could make corosin a potential biomarker for the consumption of these foods. |
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| Structure | CC(CCC(O)=O)C1CC(=O)C2(C)C3=C(C(=O)C(O)C12C)C1(C)CCC(O)C(C)(CO)C1CC3=O InChI=1S/C27H38O8/c1-13(6-7-19(32)33)14-10-18(31)27(5)20-15(29)11-16-24(2,9-8-17(30)25(16,3)12-28)21(20)22(34)23(35)26(14,27)4/h13-14,16-17,23,28,30,35H,6-12H2,1-5H3,(H,32,33) |
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| Synonyms | | Value | Source |
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| Capsularone | HMDB | | Trachelosperogenin a | HMDB | | Vismiaefolic acid | HMDB | | 3b,12b,28-Trihydroxy-7,11,15-trioxo-25,26,27-trisnorlanost-8-en-24-Oic acid | HMDB | | 3b,12b-Dihydroxy-4a-hydroxymethyl-4b,14a-dimethyl-7,11,15-trioxo-5a-chol-8-en-24-Oic acid, 9ci | HMDB | | 4-[5,16-Dihydroxy-6-(hydroxymethyl)-2,6,11,15-tetramethyl-9,12,17-trioxotetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-1(10)-en-14-yl]pentanoate | Generator | | Lucidenate J | Generator |
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| Chemical Formula | C27H38O8 |
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| Average Mass | 490.5858 Da |
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| Monoisotopic Mass | 490.25667 Da |
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| IUPAC Name | 4-[5,16-dihydroxy-6-(hydroxymethyl)-2,6,11,15-tetramethyl-9,12,17-trioxotetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-1(10)-en-14-yl]pentanoic acid |
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| Traditional Name | 4-[5,16-dihydroxy-6-(hydroxymethyl)-2,6,11,15-tetramethyl-9,12,17-trioxotetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-1(10)-en-14-yl]pentanoic acid |
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| CAS Registry Number | Not Available |
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| SMILES | CC(CCC(O)=O)C1CC(=O)C2(C)C3=C(C(=O)C(O)C12C)C1(C)CCC(O)C(C)(CO)C1CC3=O |
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| InChI Identifier | InChI=1S/C27H38O8/c1-13(6-7-19(32)33)14-10-18(31)27(5)20-15(29)11-16-24(2,9-8-17(30)25(16,3)12-28)21(20)22(34)23(35)26(14,27)4/h13-14,16-17,23,28,30,35H,6-12H2,1-5H3,(H,32,33) |
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| InChI Key | HAVMVUFJSIMVDG-UHFFFAOYSA-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 | | Species Name | Source | Reference |
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| Agaricus bisporus | FooDB | - Shmuel Yannai Dictionary of Food Compounds with CD-ROM: Additives, Flavors, and Ingredients. Chap...
| | Ganoderma lucidum | Fungi | | | Pleurotus ostreatus | FooDB | - Shmuel Yannai Dictionary of Food Compounds with CD-ROM: Additives, Flavors, and Ingredients. Chap...
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| Chemical Taxonomy |
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| Description | Belongs to the class of organic compounds known as triterpenoids. These are terpene molecules containing six isoprene units. |
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| Kingdom | Organic compounds |
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| Super Class | Lipids and lipid-like molecules |
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| Class | Prenol lipids |
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| Sub Class | Triterpenoids |
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| Direct Parent | Triterpenoids |
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| Alternative Parents | |
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| Substituents | - Triterpenoid
- 12-hydroxysteroid
- 15-hydroxysteroid
- Hydroxysteroid
- Steroid
- Beta-hydroxy acid
- Hydroxy acid
- Dicarboxylic acid or derivatives
- Cyclic alcohol
- Tertiary alcohol
- Secondary alcohol
- Polyol
- Carboxylic acid
- Carboxylic acid derivative
- Alcohol
- Organooxygen compound
- Hydrocarbon derivative
- Organic oxide
- Organic oxygen compound
- Carbonyl group
- Aliphatic homopolycyclic compound
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| Molecular Framework | Aliphatic homopolycyclic 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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