CHEBI:90952 - sugammadex sodium

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ChEBI Name sugammadex sodium ChEBI ID CHEBI:90952 Definition An organic sodium salt that is the octasodium salt of sugammadex. Used for reversal of neuromuscular blockade induced by rocuronium and vecuronium in adults undergoing surgery. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information ZINC000040164960 Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License [object Object] Read full article at Wikipedia Formula C72H104Na8O48S8 Net Charge 0 Average Mass 2178.017 Monoisotopic Mass 2176.26443 InChI InChI=1S/C72H112O48S8.8Na/c73-33(74)1-9-121-17-25-57-41(89)49(97)65(105-25)114-58-26(18-122-10-2-34(75)76)107-67(51(99)43(58)91)116-60-28(20-124-12-4-36(79)80)109-69(53(101)45(60)93)118-62-30(22-126-14-6-38(83)84)111-71(55(103)47(62)95)120-64-32(24-128-16-8-40(87)88)112-72(56(104)48(64)96)119-63-31(23-127-15-7-39(85)86)110-70(54(102)46(63)94)117-61-29(21-125-13-5-37(81)82)108-68(52(100)44(61)92)115-59-27(19-123-11-3-35(77)78)106-66(113-57)50(98)42(59)90;;;;;;;;/h25-32,41-72,89-104H,1-24H2,(H,73,74)(H,75,76)(H,77,78)(H,79,80)(H,81,82)(H,83,84)(H,85,86)(H,87,88);;;;;;;;/q;8*+1/p-8/t25-,26-,27-,28-,29-,30-,31-,32-,41-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-;;;;;;;;/m1......../s1 InChIKey KMGKABOMYQLLDJ-VKHHSAQNSA-F SMILES [Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].O1[C@H](CSCCC(=O)[O-])[C@@H]2[C@H](O)[C@@H](O)[C@H]1O[C@@H]3[C@H](O[C@@H]([C@@H]([C@H]3O)O)O[C@@H]4[C@H](O[C@@H]([C@@H]([C@H]4O)O)O[C@@H]5[C@H](O[C@@H]([C@@H]([C@H]5O)O)O[C@@H]6[C@H](O[C@@H]([C@@H]([C@H]6O)O)O[C@@H]7[C@H](O[C@@H]([C@@H]([C@H]7O)O)O[C@@H]8[C@H](O[C@@H]([C@@H]([C@H]8O)O)O[C@@H]9[C@H](O[C@@H]([C@@H]([C@H]9O)O)O2)CSCCC(=O)[O-])CSCCC(=O)[O-])CSCCC(=O)[O-])CSCCC(=O)[O-])CSCCC(=O)[O-])CSCCC([O-])=O)CSCCC(=O)[O-] Roles Classification Application(s): neuromuscular agent A drug used for its actions on skeletal muscle. View more via ChEBI Ontology ChEBI Ontology Outgoing sugammadex sodium (CHEBI:90952) has part sugammadex(8−) (CHEBI:90957) sugammadex sodium (CHEBI:90952) has role neuromuscular agent (CHEBI:51372) sugammadex sodium (CHEBI:90952) is a organic sodium salt (CHEBI:38700) Synonym Source Org 25969 ChemIDplus Manual Xrefs Databases D05940 KEGG DRUG Sugammadex Wikipedia View more database links Registry Numbers Types Sources 343306-79-6 CAS Registry Number KEGG DRUG 343306-79-6 CAS Registry Number ChemIDplus 9115720 Reaxys Registry Number Reaxys Citations Types Sources 26271275 PubMed citation Europe PMC 26322661 PubMed citation Europe PMC 26351827 PubMed citation Europe PMC 26362958 PubMed citation Europe PMC 26394365 PubMed citation Europe PMC 26398716 PubMed citation Europe PMC 26409923 PubMed citation Europe PMC 26437545 PubMed citation Europe PMC 26437551 PubMed citation Europe PMC 26437552 PubMed citation Europe PMC 26449072 PubMed citation Europe PMC 26456087 PubMed citation Europe PMC 26472231 PubMed citation Europe PMC 26485626 PubMed citation Europe PMC 26505986 PubMed citation Europe PMC 26508869 PubMed citation Europe PMC 26533808 PubMed citation Europe PMC 26534102 PubMed citation Europe PMC 26558858 PubMed citation Europe PMC 26558863 PubMed citation Europe PMC 26558864 PubMed citation Europe PMC 26597732 PubMed citation Europe PMC 26634077 PubMed citation Europe PMC 26646837 PubMed citation Europe PMC 26648135 PubMed citation Europe PMC 26673602 PubMed citation Europe PMC 26685122 PubMed citation Europe PMC 26747019 PubMed citation Europe PMC 26748952 PubMed citation Europe PMC 26750413 PubMed citation Europe PMC 26750414 PubMed citation Europe PMC Last Modified 15 January 2016