Cas no 126988-91-8 (1,6,11,16,22,27-Hexaazacyclodotriacontane-2,5,12,15,23,26-hexone,1,11,22-trihydroxy-)

1,6,11,16,22,27-Hexaazacyclodotriacontane-2,5,12,15,23,26-hexone,1,11,22-trihydroxy- structure
126988-91-8 structure
Product Name:1,6,11,16,22,27-Hexaazacyclodotriacontane-2,5,12,15,23,26-hexone,1,11,22-trihydroxy-
CAS No:126988-91-8
MF:C26H46N6O9
MW:586.678246974945
MDL:MFCD27967769
CID:199817
PubChem ID:14671620
Update Time:2025-04-19

1,6,11,16,22,27-Hexaazacyclodotriacontane-2,5,12,15,23,26-hexone,1,11,22-trihydroxy- Chemical and Physical Properties

Names and Identifiers

    • 1,6,11,16,22,27-Hexaazacyclodotriacontane-2,5,12,15,23,26-hexone,1,11,22-trihydroxy-
    • DeferrioxamineD2
    • Desferrioxamine D2
    • Proferrioxamine D2
    • cid_14671620
    • desmethylenylnocardamine
    • AKOS040736064
    • NS00097226
    • NCGC00180613-01
    • HMS2269F05
    • 1,11,22-tris(oxidanyl)-1,6,11,16,22,27-hexazacyclodotriacontane-2,5,12,15,23,26-hexone
    • BDBM77562
    • CHEBI:181598
    • SMR000440712
    • ACon0_001492
    • 126988-91-8
    • Proferrioxamine-D2
    • Proferrioxamine-D2, >=95% (LC/MS-ELSD)
    • 1,11,22-trihydroxy-1,6,11,16,22,27-hexazacyclodotriacontane-2,5,12,15,23,26-triquinone
    • ACon1_001337
    • CHEMBL517615
    • 1,11,22-trihydroxy-1,6,11,16,22,27-hexazacyclodotriacontane-2,5,12,15,23,26-hexone
    • MLS000863563
    • DTXSID001347778
    • MEGxm0_000271
    • MDL: MFCD27967769
    • Inchi: 1S/C26H46N6O9/c33-21-9-12-24(36)30(39)18-6-2-4-16-28-22(34)10-14-26(38)32(41)20-8-5-17-29-23(35)11-13-25(37)31(40)19-7-1-3-15-27-21/h39-41H,1-20H2,(H,27,33)(H,28,34)(H,29,35)
    • InChI Key: SXTGVXKFOVZYIK-UHFFFAOYSA-N
    • SMILES: ON1C(CCC(NCCCCCN(C(CCC(NCCCCN(C(CCC(NCCCCC1)=O)=O)O)=O)=O)O)=O)=O

Computed Properties

  • Exact Mass: 586.33288
  • Monoisotopic Mass: 586.33262707g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 6
  • Hydrogen Bond Acceptor Count: 9
  • Heavy Atom Count: 41
  • Rotatable Bond Count: 0
  • Complexity: 857
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -2.6
  • Topological Polar Surface Area: 209?2

Experimental Properties

  • PSA: 208.92

1,6,11,16,22,27-Hexaazacyclodotriacontane-2,5,12,15,23,26-hexone,1,11,22-trihydroxy- Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd.
SMB00558-1MG
Proferrioxamine-D2
126988-91-8
1mg
¥4117.06 2023-09-13

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