EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C50H98N2O9 |
| Net Charge | 0 |
| Average Mass | 871.339 |
| Monoisotopic Mass | 870.72723 |
| SMILES | CCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@H]1O[C@H](CNC(C)=O)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@H](O)CCCCCCCCCCCCCC |
| InChI | InChI=1S/C50H98N2O9/c1-4-6-8-10-12-14-16-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-45(55)52-42(40-60-50-49(59)48(58)47(57)44(61-50)39-51-41(3)53)46(56)43(54)37-35-33-31-29-27-17-15-13-11-9-7-5-2/h42-44,46-50,54,56-59H,4-40H2,1-3H3,(H,51,53)(H,52,55)/t42-,43+,44+,46-,47-,48-,49+,50-/m0/s1 |
| InChIKey | VITDDUXZOHEQMU-BYSUZVQFSA-N |
| Roles Classification |
|---|
| Application: | antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| abx-196 (CHEBI:757915) has role antineoplastic agent (CHEBI:35610) |
| abx-196 (CHEBI:757915) is a O-acyl carbohydrate (CHEBI:52782) |
| Synonyms | Source |
|---|---|
| Abx 196 | ChEMBL |
| ABX-196 | ChEMBL |
| ABX196 | ChEMBL |
| PBS 96 | ChEMBL |
| PBS96 | ChEMBL |