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bivalirudin |
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CHEBI:59173 |
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A synthetic peptide of 20 amino acids, comprising D-Phe, Pro, Arg, Pro, Gly, Gly, Gly, Gly, Asn, Gly, Asp, Phe, Glu, Glu, Ile, Pro, Glu, Glu, Tyr, and Leu in sequence. A congener of hirudin (a naturally occurring drug found in the saliva of the medicinal leech), it a specific and reversible inhibitor of thrombin, and is used as an anticoagulant. |
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![](images/goldenstar.gif) ![](images/goldenstar.gif)
This entity has been manually annotated by the ChEBI Team.
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Molfile
XML
SDF
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InChI=1S/C98H138N24O33/c1- 5- 52(4) 82(96(153) 122- 39- 15- 23- 70(122) 92(149) 114- 60(30- 34- 79(134) 135) 85(142) 111- 59(29- 33- 78(132) 133) 86(143) 116- 64(43- 55- 24- 26- 56(123) 27- 25- 55) 89(146) 118- 67(97(154) 155) 40- 51(2) 3) 119- 87(144) 61(31- 35- 80(136) 137) 112- 84(141) 58(28- 32- 77(130) 131) 113- 88(145) 63(42- 54- 18- 10- 7- 11- 19- 54) 117- 90(147) 66(45- 81(138) 139) 110- 76(129) 50- 107- 83(140) 65(44- 71(100) 124) 109- 75(128) 49- 106- 73(126) 47- 104- 72(125) 46- 105- 74(127) 48- 108- 91(148) 68- 21- 13- 38- 121(68) 95(152) 62(20- 12- 36- 103- 98(101) 102) 115- 93(150) 69- 22- 14- 37- 120(69) 94(151) 57(99) 41- 53- 16- 8- 6- 9- 17- 53/h6- 11,16- 19,24- 27,51- 52,57- 70,82,123H,5,12- 15,20- 23,28- 50,99H2,1- 4H3,(H2,100,124) (H,104,125) (H,105,127) (H,106,126) (H,107,140) (H,108,148) (H,109,128) (H,110,129) (H,111,142) (H,112,141) (H,113,145) (H,114,149) (H,115,150) (H,116,143) (H,117,147) (H,118,146) (H,119,144) (H,130,131) (H,132,133) (H,134,135) (H,136,137) (H,138,139) (H,154,155) (H4,101,102,103) /t52- ,57+,58- ,59- ,60- ,61- ,62- ,63- ,64- ,65- ,66- ,67- ,68- ,69- ,70- ,82- /m0/s1 |
OIRCOABEOLEUMC-GEJPAHFPSA-N |
CC[C@H] (C) [C@H] (NC(=O) [C@H] (CCC(O) =O) NC(=O) [C@H] (CCC(O) =O) NC(=O) [C@H] (Cc1ccccc1) NC(=O) [C@H] (CC(O) =O) NC(=O) CNC(=O) [C@H] (CC(N) =O) NC(=O) CNC(=O) CNC(=O) CNC(=O) CNC(=O) [C@@H] 1CCCN1C(=O) [C@H] (CCCNC(N) =N) NC(=O) [C@@H] 1CCCN1C(=O) [C@H] (N) Cc1ccccc1) C(=O) N1CCC[C@H] 1C(=O) N[C@@H] (CCC(O) =O) C(=O) N[C@@H] (CCC(O) =O) C(=O) N[C@@H] (Cc1ccc(O) cc1) C(=O) N[C@@H] (CC(C) C) C(O) =O |
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Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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EC 3.4.21.5 (thrombin) inhibitor
An EC 3.4.21.* (serine endopeptidase) inhibitor that interferes with the action of thrombin (EC 3.4.21.5).
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anticoagulant
An agent that prevents blood clotting.
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View more via ChEBI Ontology
D- phenylalanyl- L- prolyl- L- arginyl- L- prolylglycylglycylglycylglycyl- L- asparaginylglycyl- L- α- aspartyl- L- phenylalanyl- L- α- glutamyl- L- α- glutamyl- L- isoleucyl- L- prolyl- L- α- glutamyl- L- alpha- glutamyl- L- tyrosyl- L- leucine
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(2S)- 2- [[(2S)- 2- [[(2S)- 2- [[(2S)- 2- [[(2S)- 1- [(2S,3S)- 2- [[(2S)- 2- [[(2S)- 2- [[(2S)- 2- [[(2S)- 2- [[2- [[(2S)- 4- amino- 2- [[2- [[2- [[2- [[2- [[(2S)- 1- [(2S)- 2- [[(2S)- 1- [(2R)- 2- amino- 3- cyclohexylpropanoyl]pyrrolidine- 2- carbonyl]amino]- 5- carbamimidamidopentanoyl]pyrrolidine- 2- carbonyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]- 4- oxobutanoyl]amino]acetyl]amino]- 4- hydroxy- 4- oxobutanoyl]amino]- 3- cyclohexylpropanoyl]amino]- 5- hydroxy- 5- oxopentanoyl]amino]- 5- hydroxy- 5- oxopentanoyl]amino]- 3- methylpentanoyl]pyrrolidine- 2- carbonyl]amino]- 5- hydroxy- 5- oxopentanoyl]amino]- 5- hydroxy- 5- oxopentanoyl]amino]- 3- (4- hydroxyphenyl)propanoyl]amino]- 4- methylpentanoic acid
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DrugBank
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bivalirudina
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ChEBI
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bivalirudine
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ChEBI
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bivalirudinum
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ChEBI
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12004535
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Beilstein Registry Number
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Beilstein
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128270-60-0
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CAS Registry Number
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ChemIDplus
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28844201
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PubMed citation
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Europe PMC
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29086730
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29276283
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29342377
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29345439
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29345440
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29345441
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29345444
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29544607
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29563377
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29600024
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