| Record Information |
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| Version | 2.0 |
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| Created at | 2022-09-07 20:35:13 UTC |
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| Updated at | 2022-09-07 20:35:13 UTC |
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| NP-MRD ID | NP0255921 |
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| Secondary Accession Numbers | None |
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| Natural Product Identification |
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| Common Name | (11r)-1,3,7,8-tetrahydroxy-4-(3-methylbut-2-en-1-yl)-11-(2-methylprop-1-en-1-yl)-11h-5,10-dioxatetraphen-12-one |
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| Description | (11R)-1,3,7,8-tetrahydroxy-4-(3-methylbut-2-en-1-yl)-11-(2-methylprop-1-en-1-yl)-11,12-dihydro-5,10-dioxatetraphen-12-one belongs to the class of organic compounds known as pyranoflavonoids. Pyranoflavonoids are compounds containing a pyran ring fused to a 2-phenyl-1,4-benzopyran skeleton. (11r)-1,3,7,8-tetrahydroxy-4-(3-methylbut-2-en-1-yl)-11-(2-methylprop-1-en-1-yl)-11h-5,10-dioxatetraphen-12-one is found in Artocarpus altilis and Artocarpus chama. Based on a literature review very few articles have been published on (11R)-1,3,7,8-tetrahydroxy-4-(3-methylbut-2-en-1-yl)-11-(2-methylprop-1-en-1-yl)-11,12-dihydro-5,10-dioxatetraphen-12-one. |
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| Structure | CC(C)=CCC1=C2OC3=C([C@H](OC4=CC(O)=C(O)C=C34)C=C(C)C)C(=O)C2=C(O)C=C1O InChI=1S/C25H24O7/c1-11(2)5-6-13-15(26)9-18(29)21-23(30)22-20(7-12(3)4)31-19-10-17(28)16(27)8-14(19)25(22)32-24(13)21/h5,7-10,20,26-29H,6H2,1-4H3/t20-/m1/s1 |
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| Synonyms | Not Available |
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| Chemical Formula | C25H24O7 |
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| Average Mass | 436.4600 Da |
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| Monoisotopic Mass | 436.15220 Da |
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| IUPAC Name | (11R)-1,3,7,8-tetrahydroxy-4-(3-methylbut-2-en-1-yl)-11-(2-methylprop-1-en-1-yl)-11,12-dihydro-5,10-dioxatetraphen-12-one |
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| Traditional Name | (11R)-1,3,7,8-tetrahydroxy-4-(3-methylbut-2-en-1-yl)-11-(2-methylprop-1-en-1-yl)-11H-5,10-dioxatetraphen-12-one |
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| CAS Registry Number | Not Available |
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| SMILES | CC(C)=CCC1=C2OC3=C([C@H](OC4=CC(O)=C(O)C=C34)C=C(C)C)C(=O)C2=C(O)C=C1O |
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| InChI Identifier | InChI=1S/C25H24O7/c1-11(2)5-6-13-15(26)9-18(29)21-23(30)22-20(7-12(3)4)31-19-10-17(28)16(27)8-14(19)25(22)32-24(13)21/h5,7-10,20,26-29H,6H2,1-4H3/t20-/m1/s1 |
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| InChI Key | HEXPWLIZWQZUCB-HXUWFJFHSA-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 pyranoflavonoids. Pyranoflavonoids are compounds containing a pyran ring fused to a 2-phenyl-1,4-benzopyran skeleton. |
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| Kingdom | Organic compounds |
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| Super Class | Phenylpropanoids and polyketides |
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| Class | Flavonoids |
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| Sub Class | Pyranoflavonoids |
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| Direct Parent | Pyranoflavonoids |
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| Alternative Parents | |
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| Substituents | - Pyranoflavonoid
- Chromone
- Benzopyran
- 1-benzopyran
- 1-hydroxy-2-unsubstituted benzenoid
- Alkyl aryl ether
- Pyranone
- Pyran
- Benzenoid
- Heteroaromatic compound
- Vinylogous acid
- Oxacycle
- Polyol
- Ether
- Organoheterocyclic compound
- Organic oxygen compound
- Organooxygen compound
- Hydrocarbon derivative
- Organic oxide
- 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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