EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:180911 - suramin(6−)

Default Structure
ChEBI IDCHEBI:180911
ChEBI Namesuramin(6−)
Stars
ASCII Namesuramin(6-)
DefinitionAn organosulfate oxoanion that is the hexanion of suramin resulting from the deprotonation of the six sulfo groups; major species at pH 7.3.
Last Modified8 February 2022
SubmitterAdnan
DownloadsMolfile
FormulaC51H34N6O23S6
Net Charge-6
Average Mass1291.254
Monoisotopic Mass1290.00325
SMILESCc1ccc(C(=O)Nc2ccc(S(=O)(=O)[O-])c3cc(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c23)cc1NC(=O)c1cccc(NC(=O)Nc2cccc(C(=O)Nc3cc(C(=O)Nc4ccc(S(=O)(=O)[O-])c5cc(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c45)ccc3C)c2)c1
InChIInChI=1S/C51H40N6O23S6/c1-25-9-11-29(49(60)54-37-13-15-41(83(69,70)71)35-21-33(81(63,64)65)23-43(45(35)37)85(75,76)77)19-39(25)56-47(58)27-5-3-7-31(17-27)52-51(62)53-32-8-4-6-28(18-32)48(59)57-40-20-30(12-10-26(40)2)50(61)55-38-14-16-42(84(72,73)74)36-22-34(82(66,67)68)24-44(46(36)38)86(78,79)80/h3-24H,1-2H3,(H,54,60)(H,55,61)(H,56,58)(H,57,59)(H2,52,53,62)(H,63,64,65)(H,66,67,68)(H,69,70,71)(H,72,73,74)(H,75,76,77)(H,78,79,80)/p-6
InChIKeyFIAFUQMPZJWCLV-UHFFFAOYSA-H
ChEBI Ontology
Outgoing Relation(s)
suramin(6−) (CHEBI:180911) is a organosulfate oxoanion (CHEBI:58958)
suramin(6−) (CHEBI:180911) is conjugate base of suramin (CHEBI:45906)
Incoming Relation(s)
suramin sodium (CHEBI:9364) has part suramin(6−) (CHEBI:180911)
suramin (CHEBI:45906) is conjugate acid of suramin(6−) (CHEBI:180911)
IUPAC Name 
8,8'-{carbonylbis[iminobenzene-3,1-diylcarbonylimino(4-methylbenzene-3,1-diyl)carbonylimino]}dinaphthalene-1,3,5-trisulfonate
Synonym  Source
suramin hexanionChEBI
UniProt Name  Source
suraminUniProt