EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C46H83N13O11 |
| Net Charge | 0 |
| Average Mass | 994.250 |
| Monoisotopic Mass | 993.63350 |
| SMILES | CCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)CN(C)C(C)=O)C(C)C)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC)[C@@H](C)CC |
| InChI | InChI=1S/C46H83N13O11/c1-12-18-30(39(64)55-36(26(7)13-2)42(67)53-31(19-16-21-50-46(47)48)45(70)59-22-17-20-32(59)40(65)49-15-4)52-44(69)38(28(9)60)57-43(68)37(27(8)14-3)56-41(66)35(25(5)6)54-33(62)23-51-34(63)24-58(11)29(10)61/h25-28,30-32,35-38,60H,12-24H2,1-11H3,(H,49,65)(H,51,63)(H,52,69)(H,53,67)(H,54,62)(H,55,64)(H,56,66)(H,57,68)(H4,47,48,50)/t26-,27-,28+,30-,31-,32-,35-,36-,37+,38-/m0/s1 |
| InChIKey | RIWLPSIAFBLILR-WVNGMBSFSA-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) |
| abt-510 (CHEBI:748709) has role antineoplastic agent (CHEBI:35610) |
| abt-510 (CHEBI:748709) is a peptide (CHEBI:16670) |
| Synonyms | Source |
|---|---|
| Abt-510 | ChEMBL |
| ABT 510 | ChEMBL |
| ABT-526 | ChEMBL |
| Citations |
|---|