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CHEBI:41774 - tamoxifen
| Formula | C26H29NO |
| Net Charge | 0 |
| Average Mass | 371.524 |
| Monoisotopic Mass | 371.22491 |
| SMILES | CC/C(=C(\c1ccccc1)c1ccc(OCCN(C)C)cc1)c1ccccc1 |
| InChI | InChI=1S/C26H29NO/c1-4-25(21-11-7-5-8-12-21)26(22-13-9-6-10-14-22)23-15-17-24(18-16-23)28-20-19-27(2)3/h5-18H,4,19-20H2,1-3H3/b26-25- |
| InChIKey | NKANXQFJJICGDU-QPLCGJKRSA-N |
| Wikipedia |
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| Roles Classification |
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| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| Biological Roles: | EC 2.7.11.13 (protein kinase C) inhibitor An EC 2.7.11.* (protein-serine/threonine kinase) inhibitor that interferes with the action of protein kinase C (EC 2.7.11.13). estrogen receptor antagonist An antagonist at the estrogen receptor. EC 1.2.3.1 (aldehyde oxidase) inhibitor An EC 1.2.3.* (oxidoreductase acting on donor aldehyde/oxo group with oxygen as acceptor) inhibitor which interferes with the action of aldehyde oxidase (EC 1.2.3.1). estrogen antagonist A compound which inhibits or antagonises the biosynthesis or actions of estrogens. |
| Applications: | angiogenesis inhibitor An agent and endogenous substances that antagonize or inhibit the development of new blood vessels. bone density conservation agent An agent that inhibits bone resorption and/or favor bone mineralization and bone regeneration. Used to heal bone fractures and to treat bone diseases such as osteopenia and osteoporosis. estrogen receptor modulator A substance that possess antiestrogenic actions but can also produce estrogenic effects as well. It acts as complete or partial agonist or as antagonist. It can be either steroidal or nonsteroidal in structure. estrogen receptor antagonist An antagonist at the estrogen receptor. antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. estrogen antagonist A compound which inhibits or antagonises the biosynthesis or actions of estrogens. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| tamoxifen (CHEBI:41774) has parent hydride stilbene (CHEBI:26775) |
| tamoxifen (CHEBI:41774) has role angiogenesis inhibitor (CHEBI:48422) |
| tamoxifen (CHEBI:41774) has role antineoplastic agent (CHEBI:35610) |
| tamoxifen (CHEBI:41774) has role bone density conservation agent (CHEBI:50646) |
| tamoxifen (CHEBI:41774) has role EC 1.2.3.1 (aldehyde oxidase) inhibitor (CHEBI:62872) |
| tamoxifen (CHEBI:41774) has role EC 2.7.11.13 (protein kinase C) inhibitor (CHEBI:37700) |
| tamoxifen (CHEBI:41774) has role estrogen antagonist (CHEBI:50837) |
| tamoxifen (CHEBI:41774) has role estrogen receptor antagonist (CHEBI:50792) |
| tamoxifen (CHEBI:41774) has role estrogen receptor modulator (CHEBI:50739) |
| tamoxifen (CHEBI:41774) is a stilbenoid (CHEBI:26776) |
| tamoxifen (CHEBI:41774) is a tertiary amino compound (CHEBI:50996) |
| Incoming Relation(s) |
| afimoxifene (CHEBI:44616) has functional parent tamoxifen (CHEBI:41774) |
| tamoxifen N-oxide (CHEBI:63825) has functional parent tamoxifen (CHEBI:41774) |
| tamoxifen citrate (CHEBI:9397) has part tamoxifen (CHEBI:41774) |
| IUPAC Name |
|---|
| 2-{4-[(1Z)-1,2-diphenylbut-1-en-1-yl]phenoxy}-N,N-dimethylethanamine |
| INNs | Source |
|---|---|
| tamoxifen | ChemIDplus |
| tamoxifène | ChemIDplus |
| tamoxifeno | ChemIDplus |
| tamoxifenum | ChemIDplus |
| Synonyms | Source |
|---|---|
| 1-para-beta-Dimethylaminoethoxyphenyl-trans-1,2-diphenylbut-1-ene | ChemIDplus |
| 1-p-beta-Dimethylaminoethoxyphenyl-trans-1,2-diphenylbut-1-ene | ChemIDplus |
| Tamoxifen | KEGG COMPOUND |
| trans-Tamoxifen | ChemIDplus |
| (Z)-2-(4-(1,2-Diphenyl-1-butenyl)phenoxy)-N,N-dimethylethanamine | ChemIDplus |
| (Z)-2-(para-(1,2-Diphenyl-1-butenyl)phenoxy)-N,N-dimethylamine | ChemIDplus |
| Brand Names | Source |
|---|---|
| Apo-Tamox | DrugBank |
| Citofen | DrugBank |
| Crisafeno | DrugBank |
| Diemon | DrugBank |
| Gen-Tamoxifen | DrugBank |
| Istubol | DrugBank |
| Registry Numbers | Sources |
|---|---|
| Beilstein:2062020 | Beilstein |
| CAS:10540-29-1 | KEGG COMPOUND |
| CAS:10540-29-1 | ChemIDplus |
| Citations |
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