Icatibant Acetate

For research use only. Not for therapeutic Use.

  • CAT Number: R025936
  • CAS Number: 138614-30-9
  • Molecular Formula: C₅₉H₈₉N₁₉O₁₃S x(C ₂H₄O₂)
  • Molecular Weight: 1304.52
  • Purity: ≥95%
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Icatibant Acetate(Cat No.:R025936)is a potent synthetic peptide and bradykinin B2 receptor antagonist, primarily used in the treatment of hereditary angioedema (HAE). By blocking bradykinin receptors, it effectively reduces the swelling, pain, and inflammation associated with acute HAE attacks. Its precise mechanism targets the underlying cause of the condition, offering rapid symptom relief. Due to its efficacy and targeted action, Icatibant Acetate is a critical therapeutic agent in managing HAE and is valuable in ongoing research into bradykinin-related pathways.


Catalog Number R025936
CAS Number 138614-30-9
Synonyms

D-Arginyl-L-arginyl-L-prolyl-(4R)-4-hydroxy-L-prolylglycyl-3-(2-thienyl)-L-alanyl-L-seryl-(3R)-1,2,3,4-tetrahydro-3-isoquinolinecarbonyl-(2S,3aS,7aS)-octahydro-1H-indole-2-carbonyl-L-arginine Acetate Salt; D-Arginyl-L-arginyl-L-prolyl-trans-4-hydroxy

Molecular Formula C₅₉H₈₉N₁₉O₁₃S x(C ₂H₄O₂)
Purity ≥95%
Target Bradykinin Receptor
Storage Store at -20C
IUPAC Name (2S)-2-[[(2S,3aS,7aS)-1-[(3R)-2-[(2S)-2-[[(2S)-2-[[2-[[(2S,4R)-1-[(2S)-1-[(2S)-2-[[(2R)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]-4-hydroxypyrrolidine-2-carbonyl]amino]acetyl]amino]-3-thiophen-2-ylpropanoyl]amino]-3-hydroxypropanoyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carbonyl]amino]-5-(diaminomethylideneamino)pentanoic acid;acetic acid
InChI InChI=1S/C59H89N19O13S.C2H4O2/c60-37(14-5-19-67-57(61)62)48(82)72-38(15-6-20-68-58(63)64)52(86)75-22-8-18-43(75)54(88)77-30-35(80)26-44(77)50(84)70-28-47(81)71-40(27-36-13-9-23-92-36)49(83)74-41(31-79)53(87)76-29-34-12-2-1-10-32(34)24-46(76)55(89)78-42-17-4-3-11-33(42)25-45(78)51(85)73-39(56(90)91)16-7-21-69-59(65)66;1-2(3)4/h1-2,9-10,12-13,23,33,35,37-46,79-80H,3-8,11,14-22,24-31,60H2,(H,70,84)(H,71,81)(H,72,82)(H,73,85)(H,74,83)(H,90,91)(H4,61,62,67)(H4,63,64,68)(H4,65,66,69);1H3,(H,3,4)/t33-,35+,37+,38-,39-,40-,41-,42-,43-,44-,45-,46+;/m0./s1
InChIKey HKMZRZUEADSZDQ-DZJWSCHMSA-N
SMILES CC(=O)O.C1CCC2C(C1)CC(N2C(=O)C3CC4=CC=CC=C4CN3C(=O)C(CO)NC(=O)C(CC5=CC=CS5)NC(=O)CNC(=O)C6CC(CN6C(=O)C7CCCN7C(=O)C(CCCN=C(N)N)NC(=O)C(CCCN=C(N)N)N)O)C(=O)NC(CCCN=C(N)N)C(=O)O

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