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CHEBI:7609 - nomilin
| Formula | C28H34O9 |
| Net Charge | 0 |
| Average Mass | 514.571 |
| Monoisotopic Mass | 514.22028 |
| SMILES | [H][C@]12CC[C@@]3(C)[C@H](c4ccoc4)OC(=O)[C@H]4O[C@]43[C@]1(C)C(=O)C[C@@]1([H])C(C)(C)OC(=O)C[C@H](OC(C)=O)[C@]21C |
| InChI | InChI=1S/C28H34O9/c1-14(29)34-19-12-20(31)36-24(2,3)17-11-18(30)27(6)16(26(17,19)5)7-9-25(4)21(15-8-10-33-13-15)35-23(32)22-28(25,27)37-22/h8,10,13,16-17,19,21-22H,7,9,11-12H2,1-6H3/t16-,17+,19+,21+,22-,25+,26-,27+,28-/m1/s1 |
| InChIKey | KPDOJFFZKAUIOE-WNGDLQANSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Citrus junos (ncbitaxon:135197) | - | PubMed (33991286) | Isolated from the peel. |
| Citrus limettioides (ncbitaxon:200542) | - | PubMed (38088731) | |
| Citrus maxima (ncbitaxon:37334) | - | PubMed (25212475) | Species also known as Citrus grandis. |
| Roles Classification |
|---|
| Chemical Role: | antioxidant A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides. |
| Biological Roles: | anti-obesity agent Any substance which is used to reduce or control weight. apoptosis inducer Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms. plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. pregnane X receptor agonist An agonist that selectively binds to and activates a pregnane X receptor. anti-HIV-1 agent An anti-HIV agent that destroys or inhibits the replication of HIV-1, the more infective and more virulent of the two types of HIV virus. immunomodulator Biologically active substance whose activity affects or plays a role in the functioning of the immune system. |
| Applications: | geroprotector Any compound that supports healthy aging, slows the biological aging process, or extends lifespan. hypoglycemic agent A drug which lowers the blood glucose level. antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. skin lightening agent Any cosmetic used to lighten the colour of skin by reducing the concentration of melanin. anti-inflammatory agent Any compound that has anti-inflammatory effects. angiogenesis inhibitor An agent and endogenous substances that antagonize or inhibit the development of new blood vessels. immunomodulator Biologically active substance whose activity affects or plays a role in the functioning of the immune system. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| nomilin (CHEBI:7609) has role angiogenesis inhibitor (CHEBI:48422) |
| nomilin (CHEBI:7609) has role anti-HIV-1 agent (CHEBI:64947) |
| nomilin (CHEBI:7609) has role anti-inflammatory agent (CHEBI:67079) |
| nomilin (CHEBI:7609) has role anti-obesity agent (CHEBI:74518) |
| nomilin (CHEBI:7609) has role antineoplastic agent (CHEBI:35610) |
| nomilin (CHEBI:7609) has role antioxidant (CHEBI:22586) |
| nomilin (CHEBI:7609) has role apoptosis inducer (CHEBI:68495) |
| nomilin (CHEBI:7609) has role geroprotector (CHEBI:176497) |
| nomilin (CHEBI:7609) has role hypoglycemic agent (CHEBI:35526) |
| nomilin (CHEBI:7609) has role immunomodulator (CHEBI:50846) |
| nomilin (CHEBI:7609) has role plant metabolite (CHEBI:76924) |
| nomilin (CHEBI:7609) has role pregnane X receptor agonist (CHEBI:77318) |
| nomilin (CHEBI:7609) has role skin lightening agent (CHEBI:85046) |
| nomilin (CHEBI:7609) is a acetate ester (CHEBI:47622) |
| nomilin (CHEBI:7609) is a epoxide (CHEBI:32955) |
| nomilin (CHEBI:7609) is a furans (CHEBI:24129) |
| nomilin (CHEBI:7609) is a lactone (CHEBI:25000) |
| nomilin (CHEBI:7609) is a limonoid (CHEBI:39434) |
| nomilin (CHEBI:7609) is a organic heteropentacyclic compound (CHEBI:38164) |
| nomilin (CHEBI:7609) is a pentacyclic triterpenoid (CHEBI:25872) |
| IUPAC Name |
|---|
| (5S,5aR,5bR,7aS,8S,10aS,11aR,11bR,13aR)-8-(furan-3-yl)-1,1,5a,7a,11b-pentamethyl-3,10,12-trioxohexadecahydrooxireno[4,4a]isochromeno[6,5-g][2]benzoxepin-5-yl acetate |
| Synonyms | Source |
|---|---|
| 1-(acetyloxy)-1,2-dihydro-obacunoic acid ε-lactone | ChEBI |
| (1S,3aS,4aR,4bR,6aR,11S,11aR,11bR,13aS)-11-(acetyloxy)-1-(3-furanyl)decahydro-4b,7,7,11a,13a-pentamethyloxireno[4,4a]-2-benzopyrano[6,5-g][2]benzoxepin-3,5,9(3aH,4bH,6H)-trione | ChEBI |
| nomilin | KEGG COMPOUND |
| Citations |
|---|