EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C39H48N8O14 |
| Net Charge | 0 |
| Average Mass | 852.855 |
| Monoisotopic Mass | 852.32900 |
| SMILES | N=C(N)NCCC[C@H](NC(=O)CCC(=O)OC[N+]1(c2cc(=O)c3cccc(-c4ccccc4)c3o2)CCOCC1)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)[O-] |
| InChI | InChI=1S/C39H48N8O14/c40-39(41)42-13-5-10-26(36(55)43-20-31(51)45-27(18-33(52)53)37(56)46-28(21-48)38(57)58)44-30(50)11-12-34(54)60-22-47(14-16-59-17-15-47)32-19-29(49)25-9-4-8-24(35(25)61-32)23-6-2-1-3-7-23/h1-4,6-9,19,26-28,48H,5,10-18,20-22H2,(H9-,40,41,42,43,44,45,46,50,51,52,53,55,56,57,58)/t26-,27-,28-/m0/s1 |
| InChIKey | SVNJBEMPMKWDCO-KCHLEUMXSA-N |
| Roles Classification |
|---|
| 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) |
| sf-1126 (CHEBI:754947) has role antineoplastic agent (CHEBI:35610) |
| sf-1126 (CHEBI:754947) is a polypeptide (CHEBI:15841) |
| Synonyms | Source |
|---|---|
| SF 1126 | ChEMBL |
| SF-1126 | ChEMBL |
| SF-1126 INNER SALT | ChEMBL |
| Citations |
|---|