CHEBI:45906 - suramin

Main ChEBI Ontology Automatic Xrefs
ChEBI Name suramin
ChEBI ID CHEBI:45906
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:45904, CHEBI:9363
Supplier Information
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Formula C51H40N6O23S6
Net Charge 0
Average Mass 1297.28594
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)
InChIKey FIAFUQMPZJWCLV-UHFFFAOYSA-N
SMILES Cc1ccc(cc1NC(=O)c1cccc(NC(=O)Nc2cccc(c2)C(=O)Nc2cc(ccc2C)C(=O)Nc2ccc(c3cc(cc(c23)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O)c1)C(=O)Nc1ccc(c2cc(cc(c12)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O
Roles Classification
Biological Role(s): trypanocidal drug
A drug used to treat or prevent infections caused by protozoal organisms belonging to the suborder Trypanosomatida.
Application(s): antinematodal drug
A substance used in the treatment or control of nematode infestations.
trypanocidal drug
A drug used to treat or prevent infections caused by protozoal organisms belonging to the suborder Trypanosomatida.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing suramin (CHEBI:45906) has functional parent naphthalene-1,3,5-trisulfonic acid (CHEBI:36334)
suramin (CHEBI:45906) has role antinematodal drug (CHEBI:35444)
suramin (CHEBI:45906) has role trypanocidal drug (CHEBI:36335)
suramin (CHEBI:45906) is a naphthalenesulfonic acid (CHEBI:36336)
IUPAC Name
8,8'-{carbonylbis[imino-3,1-phenylenecarbonylimino(4-methyl-3,1-phenylene)carbonylimino]}dinaphthalene-1,3,5-trisulfonic acid
Synonyms Sources
8,8'-[CARBONYLBIS[IMINO-3,1-PHENYLENECARBONYLIMINO(4-METHYL-3,1-PHENYLENE)CARBONYLIMINO]]BIS-1,3,5-NAPHTHALENETRISULFONIC ACID PDBeChem
Belganyl ChemIDplus
Naganol ChemIDplus
Naphuride ChemIDplus
Suramin KEGG COMPOUND
Database Links Databases
C07974 KEGG COMPOUND
DB04786 DrugBank
SVR PDBeChem
View more database links
Registry Numbers Types Sources
145-63-1 CAS Registry Number KEGG COMPOUND
145-63-1 CAS Registry Number ChemIDplus
3230873 Beilstein Registry Number ChemIDplus
8185304 Beilstein Registry Number Beilstein
Last Modified
29 June 2010