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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: | immunomodulator Biologically active substance whose activity affects or plays a role in the functioning of the immune system. 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. anti-obesity agent Any substance which is used to reduce or control weight. plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. apoptosis inducer Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms. pregnane X receptor agonist An agonist that selectively binds to and activates a pregnane X receptor. |
| Applications: | hypoglycemic agent A drug which lowers the blood glucose level. immunomodulator Biologically active substance whose activity affects or plays a role in the functioning of the immune system. angiogenesis inhibitor An agent and endogenous substances that antagonize or inhibit the development of new blood vessels. antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. anti-inflammatory agent Any compound that has anti-inflammatory effects. geroprotector Any compound that supports healthy aging, slows the biological aging process, or extends lifespan. skin lightening agent Any cosmetic used to lighten the colour of skin by reducing the concentration of melanin. |
| 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 |
|---|