CHEBI:180911 - suramin(6−)

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ChEBI Name suramin(6−) ChEBI ID CHEBI:180911 ChEBI ASCII Name suramin(6-) Definition An organosulfate oxoanion that is the hexanion of suramin resulting from the deprotonation of the six sulfo groups; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C51H34N6O23S6 Net Charge -6 Average Mass 1291.220 Monoisotopic Mass 1290.00325 InChI InChI=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 InChIKey FIAFUQMPZJWCLV-UHFFFAOYSA-H SMILES CC1=CC=C(C=C1NC(=O)C1=CC(NC(=O)NC2=CC=CC(=C2)C(=O)NC2=CC(=CC=C2C)C(=O)NC2=CC=C(C3=CC(=CC(=C23)S([O-])(=O)=O)S([O-])(=O)=O)S([O-])(=O)=O)=CC=C1)C(=O)NC1=CC=C(C2=CC(=CC(=C12)S([O-])(=O)=O)S([O-])(=O)=O)S([O-])(=O)=O ChEBI Ontology Outgoing suramin(6−) (CHEBI:180911) is a organosulfate oxoanion (CHEBI:58958) suramin(6−) (CHEBI:180911) is conjugate base of suramin (CHEBI:45906) Incoming 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 Synonyms Sources suramin UniProt suramin hexanion ChEBI Last Modified 08 February 2022