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| Formula | C44H58N8O5S |
| Net Charge | 0 |
| Average Mass | 811.066 |
| Monoisotopic Mass | 810.42509 |
| SMILES | CCn1c(-c2cc(N3CCN(C)CC3)cnc2[C@H](C)OC)c2c3cc(ccc31)-c1csc(n1)C[C@H](NC(=O)[C@H]1C[C@@H]1C)C(=O)N1CCC[C@H](N1)C(=O)OCC(C)(C)C2 |
| InChI | InChI=1S/C44H58N8O5S/c1-8-51-37-12-11-28-19-31(37)33(40(51)32-20-29(23-45-39(32)27(3)56-7)50-16-14-49(6)15-17-50)22-44(4,5)25-57-43(55)34-10-9-13-52(48-34)42(54)35(21-38-46-36(28)24-58-38)47-41(53)30-18-26(30)2/h11-12,19-20,23-24,26-27,30,34-35,48H,8-10,13-18,21-22,25H2,1-7H3,(H,47,53)/t26-,27-,30-,34-,35-/m0/s1 |
| InChIKey | FVICRBSEYSHKFY-JYQNNKODSA-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). |
| Application: | antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| daraxonrasib (CHEBI:746946) has role antineoplastic agent (CHEBI:35610) |
| daraxonrasib (CHEBI:746946) is a N-methylpiperazine (CHEBI:46920) |
| daraxonrasib (CHEBI:746946) is a 1,3-thiazoles (CHEBI:38418) |
| daraxonrasib (CHEBI:746946) is a carboxylic ester (CHEBI:33308) |
| daraxonrasib (CHEBI:746946) is a ether (CHEBI:25698) |
| daraxonrasib (CHEBI:746946) is a indoles (CHEBI:24828) |
| daraxonrasib (CHEBI:746946) is a pyridines (CHEBI:26421) |
| daraxonrasib (CHEBI:746946) is a secondary carboxamide (CHEBI:140325) |
| daraxonrasib (CHEBI:746946) is a tertiary carboxamide (CHEBI:140326) |
| INNs | Source |
|---|---|
| daraxonrasib | WHO MedNet |
| daraxonrasib | WHO MedNet |
| daraxonrasib | WHO MedNet |
| daraxonrasibum | WHO MedNet |
| Synonyms | Source |
|---|---|
| RMC-6236 | ChEBI |
| RMC-6236 | ChEBI |
| RMC 6236 | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| Daraxonrasib | Wikipedia |
| Registry Numbers | Sources |
|---|---|
| CAS:2765081-21-6 | ChEBI |
| Citations |
|---|