Record Information |
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Version | 2.0 |
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Created at | 2022-09-06 05:36:45 UTC |
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Updated at | 2022-09-06 05:36:45 UTC |
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NP-MRD ID | NP0226536 |
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Secondary Accession Numbers | None |
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Natural Product Identification |
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Common Name | 5,8-dihydroxy-10-(2-hydroxypropan-2-yl)-1,1,2-trimethyl-4-(3-methylbut-2-en-1-yl)-2h-furo[2,3-c]xanthen-6-one |
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Description | 5,8-Dihydroxy-10-(2-hydroxypropan-2-yl)-1,1,2-trimethyl-4-(3-methylbut-2-en-1-yl)-1H,2H,6H-furo[2,3-c]xanthen-6-one belongs to the class of organic compounds known as 2-prenylated xanthones. These are organic compounds containing a C5-isoprenoid group linked to a xanthone moiety at the 2-position. Xanthone is a tricyclic compound made up of two benzene rings linearly fused to each other through a pyran ring that carries a ketone group. 5,8-dihydroxy-10-(2-hydroxypropan-2-yl)-1,1,2-trimethyl-4-(3-methylbut-2-en-1-yl)-2h-furo[2,3-c]xanthen-6-one is found in Garcinia scortechinii. 5,8-Dihydroxy-10-(2-hydroxypropan-2-yl)-1,1,2-trimethyl-4-(3-methylbut-2-en-1-yl)-1H,2H,6H-furo[2,3-c]xanthen-6-one is an extremely weak basic (essentially neutral) compound (based on its pKa). |
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Structure | CC1OC2=C(CC=C(C)C)C(O)=C3C(=O)C4=CC(O)=CC(=C4OC3=C2C1(C)C)C(C)(C)O InChI=1S/C26H30O6/c1-12(2)8-9-15-20(28)18-21(29)16-10-14(27)11-17(26(6,7)30)22(16)32-24(18)19-23(15)31-13(3)25(19,4)5/h8,10-11,13,27-28,30H,9H2,1-7H3 |
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Synonyms | Not Available |
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Chemical Formula | C26H30O6 |
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Average Mass | 438.5200 Da |
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Monoisotopic Mass | 438.20424 Da |
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IUPAC Name | 5,8-dihydroxy-10-(2-hydroxypropan-2-yl)-1,1,2-trimethyl-4-(3-methylbut-2-en-1-yl)-1H,2H,6H-furo[2,3-c]xanthen-6-one |
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Traditional Name | 5,8-dihydroxy-10-(2-hydroxypropan-2-yl)-1,1,2-trimethyl-4-(3-methylbut-2-en-1-yl)-2H-furo[2,3-c]xanthen-6-one |
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CAS Registry Number | Not Available |
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SMILES | CC1OC2=C(CC=C(C)C)C(O)=C3C(=O)C4=CC(O)=CC(=C4OC3=C2C1(C)C)C(C)(C)O |
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InChI Identifier | InChI=1S/C26H30O6/c1-12(2)8-9-15-20(28)18-21(29)16-10-14(27)11-17(26(6,7)30)22(16)32-24(18)19-23(15)31-13(3)25(19,4)5/h8,10-11,13,27-28,30H,9H2,1-7H3 |
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InChI Key | UZFQFSWIIKYKFR-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 | |
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Chemical Taxonomy |
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Description | Belongs to the class of organic compounds known as 2-prenylated xanthones. These are organic compounds containing a C5-isoprenoid group linked to a xanthone moiety at the 2-position. Xanthone is a tricyclic compound made up of two benzene rings linearly fused to each other through a pyran ring that carries a ketone group. |
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Kingdom | Organic compounds |
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Super Class | Organoheterocyclic compounds |
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Class | Benzopyrans |
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Sub Class | 1-benzopyrans |
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Direct Parent | 2-prenylated xanthones |
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Alternative Parents | |
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Substituents | - 2-prenylated xanthone
- Chromone
- Coumaran
- 1-hydroxy-2-unsubstituted benzenoid
- Alkyl aryl ether
- Pyranone
- Benzenoid
- Pyran
- Heteroaromatic compound
- Vinylogous acid
- Tertiary alcohol
- Ether
- Oxacycle
- Alcohol
- Aromatic alcohol
- Organooxygen compound
- Hydrocarbon derivative
- Organic oxide
- Organic oxygen compound
- 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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