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Substance Name: DASC 4
RN: 56776-29-5
InChIKey: IPXBRSRHEPYVLF-QDBORUFSSA-L

Molecular Weight

  • 885.8913
 
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Names and Synonyms

  • DASC 4

Registry Numbers

CAS Registry Number

  • 56776-29-5

System Generated Number

  • 0056776295

Structure Descriptors

InChI

1S/C38H39N11O8S2.2Na/c1-48(19-21-50)37-43-33(27-9-5-3-6-10-27)42-34(45-37)40-29-17-15-25(31(23-29)58(52,53)54)13-14-26-16-18-30(24-32(26)59(55,56)57)41-36-44-35(39-28-11-7-4-8-12-28)46-38(47-36)49(2)20-22-51;;/h3-18,23-24,50-51H,19-22H2,1-2H3,(H,52,53,54)(H,55,56,57)(H,40,42,43,45)(H2,39,41,44,46,47);;/q;2*+1/p-2/b14-13+;;

InChIKey

IPXBRSRHEPYVLF-QDBORUFSSA-L

Smiles

c1(c2ccccc2)nc(Nc2cc(c(\C=C\c3c(cc(Nc4nc(nc(n4)N(CCO)C)Nc4ccccc4)cc3)S(=O)(=O)[O-])cc2)S(=O)(=O)[O-])nc(n1)N(CCO)C.[Na+].[Na+]