Suramin sodiumProduct ingredient for Suramin
- Name
- Suramin sodium
- Drug Entry
- Suramin
A polyanionic compound with an unknown mechanism of action. It is used parenterally in the treatment of African trypanosomiasis and it has been used clinically with diethylcarbamazine to kill the adult Onchocerca. (From AMA Drug Evaluations Annual, 1992, p1643) It has also been shown to have potent antineoplastic properties. Suramin is manufactured by Bayer in Germany as Germanin®.
- Accession Number
- DBSALT000540
- Structure
Structure for Suramin sodium (DBSALT000540)
- Synonyms
- Not Available
- UNII
- 89521262IH
- CAS Number
- 129-46-4
- Weight
- Average: 1429.171
Monoisotopic: 1427.938573614 - Chemical Formula
- C51H34N6Na6O23S6
- InChI Key
- VAPNKLKDKUDFHK-UHFFFAOYSA-H
- InChI
- InChI=1S/C51H40N6O23S6.6Na/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);;;;;;/q;6*+1/p-6
- IUPAC Name
- hexasodium N-(4,8-disulfo-6-sulfonatonaphthalen-1-yl)-4-methyl-3-[({3-[({[3-({2-methyl-5-[(4,6,8-trisulfonaphthalen-1-yl)carboximidato]phenyl}carboximidato)phenyl]amino}(oxido)methylidene)amino]phenyl}(oxido)methylidene)amino]benzene-1-carboximidate
- SMILES
- [Na+].[Na+].[Na+].[Na+].[Na+].[Na+].CC1=C(C=C(C=C1)C([O-])=NC1=C2C(C=C(C=C2S(O)(=O)=O)S(O)(=O)=O)=C(C=C1)S(O)(=O)=O)N=C([O-])C1=CC(NC([O-])=NC2=CC=CC(=C2)C([O-])=NC2=C(C)C=CC(=C2)C([O-])=NC2=C3C(C=C(C=C3S(O)(=O)=O)S([O-])(=O)=O)=C(C=C2)S(O)(=O)=O)=CC=C1
- External Links
- PubChem Compound
- 5360
- ChemSpider
- 5167
- ChEBI
- 9364
- ChEMBL
- CHEMBL413376
- Wikipedia
- Suramin
- Predicted Properties
Property Value Source Water Solubility 0.00507 mg/mL ALOGPS logP 0.9 ALOGPS logP 9.11 Chemaxon logS -5.4 ALOGPS pKa (Strongest Acidic) -3.5 Chemaxon pKa (Strongest Basic) -7.4 Chemaxon Physiological Charge -6 Chemaxon Hydrogen Acceptor Count 29 Chemaxon Hydrogen Donor Count 6 Chemaxon Polar Surface Area 518.18 Å2 Chemaxon Rotatable Bond Count 16 Chemaxon Refractivity 370.31 m3·mol-1 Chemaxon Polarizability 122.09 Å3 Chemaxon Number of Rings 8 Chemaxon Bioavailability 0 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule Yes Chemaxon