vaniprevir potassium
chemical compound
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vaniprevir potassium
Summary
vaniprevir potassium is a group of stereoisomers[1].
Key Facts
- vaniprevir potassium's instance of is recorded as group of stereoisomers[2].
- vaniprevir potassium's CAS Registry Number is recorded as 1269195-08-5[3].
- vaniprevir potassium's canonical SMILES is recorded as CCC1CC1(C(=O)[N-]S(=O)(=O)C2CC2)NC(=O)C3CC4CN3C(=O)C(NC(=O)OCC(CCCCC5=C6CN(CC6=CC=C5)C(=O)O4)(C)C)C(C)(C)C.[K+][4].
- vaniprevir potassium's InChI is recorded as InChI=1S/C38H55N5O9S.K/c1-7-25-18-38(25,33(46)41-53(49,50)27-14-15-27)40-31(44)29-17-26-20-43(29)32(45)30(36(2,3)4)39-34(47)51-22-37(5,6)16-9-8-11-23-12-10-13-24-19-42(21-28(23)24)35(48)52-26;/h10,12-13,25-27,29-30H,7-9,11,14-22H2,1-6H3,(H3,39,40,41,44,46,47);/q;+1/p-1/t25-,26-,29+,30-,38-;/m1./s1[5].
- vaniprevir potassium's InChIKey is recorded as GCSROPQKMQJXBI-BHHZHGTGSA-M[6].
- vaniprevir potassium's chemical formula is recorded as C₃₈H₅₄KN₅O₉S[7].
- vaniprevir potassium's subclass of is recorded as chemical compound[8].
- vaniprevir potassium's UNII is recorded as W0LRK0QD50[9].
- vaniprevir potassium's ChemSpider ID is recorded as 32701350[10].
- vaniprevir potassium's PubChem CID is recorded as 76956968[11].
- vaniprevir potassium's isomeric SMILES is recorded as CC[C@@H]1C[C@@]1(C(=O)[N-]S(=O)(=O)C2CC2)NC(=O)[C@@H]3C[C@@H]4CN3C(=O)C@@HC(C)(C)C.[K+]C@@HC(C)(C)C.[K+]">[12].
- vaniprevir potassium's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+795.328'}[13].
- vaniprevir potassium's DSSTox substance ID is recorded as DTXSID40155326[14].
- vaniprevir potassium's DSSTOX compound identifier is recorded as DTXCID4077817[15].
- vaniprevir potassium's UniChem compound ID is recorded as 27304442[16].