D-Glucitol, 1-deoxy-1-(methylamino)-, 3,3′-[(1,16-dioxo-4,7,10,13-tetraoxahexadecane-1,16-diyl)diimino]bis[2,4,6-triiodobenzoate] (2:1)

CAS Registry Number®

51764-33-1
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CAS Name

D-Glucitol, 1-deoxy-1-(methylamino)-, 3,3′-[(1,16-dioxo-4,7,10,13-tetraoxahexadecane-1,16-diyl)diimino]bis[2,4,6-triiodobenzoate] (2:1)

Molecular Formula

C26H26I6N2O10.2C7H17NO5

Cite this Page

D-Glucitol, 1-deoxy-1-(methylamino)-, 3,3′-[(1,16-dioxo-4,7,10,13-tetraoxahexadecane-1,16-diyl)diimino]bis[2,4,6-triiodobenzoate] (2:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=51764-33-1 (retrieved 2024-09-19) (CAS RN: 51764-33-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C26H26I6N2O10.C7H17NO5/c27-13-11-15(29)23(21(31)19(13)25(37)38)33-17(35)1-3-41-5-7-43-9-10-44-8-6-42-4-2-18(36)34-24-16(30)12-14(28)20(22(24)32)26(39)40;1-8-2-4(10)6(12)7(13)5(11)3-9/h11-12H,1-10H2,(H,33,35)(H,34,36)(H,37,38)(H,39,40);4-13H,2-3H2,1H3/t;4-,5+,6+,7+/m.0/s1

InChIKey

InChIKey=MQAIJEPVDKNHRW-WZTVWXICSA-N

SMILES

N(C(CCOCCOCCOCCOCCC(NC1=C(I)C(C(O)=O)=C(I)C=C1I)=O)=O)C2=C(I)C(C(O)=O)=C(I)C=C2I.[C@H]([C@@H]([C@@H](CO)O)O)([C@H](CNC)O)O

Canonical SMILES

O=C(O)C=1C(I)=CC(I)=C(NC(=O)CCOCCOCCOCCOCCC(=O)NC2=C(I)C=C(I)C(C(=O)O)=C2I)C1I.OCC(O)C(O)C(O)C(O)CNC

Other Names for this Substance

  • D-Glucitol, 1-deoxy-1-(methylamino)-, 3,3′-[(1,16-dioxo-4,7,10,13-tetraoxahexadecane-1,16-diyl)diimino]bis[2,4,6-triiodobenzoate] (2:1)
  • D-Glucitol, 1-deoxy-1-(methylamino)-, 3,3′-[(1,16-dioxo-4,7,10,13-tetraoxahexadecane-1,16-diyl)diimino]bis[2,4,6-triiodobenzoate] (2:1) (salt)
  • Benzoic acid, 3,3′-[(1,16-dioxo-4,7,10,13-tetraoxahexadecane-1,16-diyl)diimino]bis[2,4,6-triiodo-, compd. with 1-deoxy-1-(methylamino)-D-glucitol (1:2)
  • Iodoxamic acid meglumine salt
  • Endobil

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Deleted or Replaced CAS Registry Numbers

39472-29-2