NSC733625
group of stereoisomers with the chemical formula C₄₀H₅₉Cl₂N₃O₄
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NSC733625
Summary
NSC733625 is a group of stereoisomers[1].
Key Facts
- NSC733625's instance of is recorded as group of stereoisomers[2].
- NSC733625's CAS Registry Number is recorded as 865070-37-7[3].
- NSC733625's canonical SMILES is recorded as CC12CC(CCCCCCNCCOC(O)=NCCCc3ccc(N(CCCl)CCCl)cc3)C3=C4CCC(=O)C=C4CCC3C1CCC2O[4].
- NSC733625's InChI is recorded as InChI=1S/C40H59Cl2N3O4/c1-40-28-31(38-34-16-14-33(46)27-30(34)11-15-35(38)36(40)17-18-37(40)47)8-4-2-3-5-21-43-23-26-49-39(48)44-22-6-7-29-9-12-32(13-10-29)45(24-19-41)25-20-42/h9-10,12-13,27,31,35-37,43,47H,2-8,11,14-26,28H2,1H3,(H,44,48)/t31-,35?,36?,37-,40-/m0/s1[5].
- NSC733625's InChIKey is recorded as NUVYGWMULLVQOM-YLUJQFMWSA-N[6].
- NSC733625's chemical formula is recorded as C₄₀H₅₉Cl₂N₃O₄[7].
- NSC733625's subclass of is recorded as chemical compound[8].
- NSC733625's PubChem CID is recorded as 11274076[9].
- NSC733625's isomeric SMILES is recorded as C[C@]12CC@HC3=C4CCC(=O)C=C4CCC3C1CC[C@@H]2OC@HC3=C4CCC(=O)C=C4CCC3C1CC[C@@H]2O">[10].
- NSC733625's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+715.3882627280002'}[11].
- NSC733625's NSC number is recorded as 733625[12].
- NSC733625's SureChEMBL ID is recorded as 16640358[13].
- NSC733625's DSSTox substance ID is recorded as DTXSID50460751[14].
- NSC733625's DSSTOX compound identifier is recorded as DTXCID40411570[15].
- NSC733625's UniChem compound ID is recorded as 33954571[16].