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TTD Drug ID: DAP000961

Drug Information
NameCeruletide
SynonymsCCRIS 3063; LS-48549; Cerulein; 17650-98-5; Ceruletide; UNII-888Y08971B; CHEBI:59219; D03442; Caerulein; 5-Oxo-L-prolyl-L-glutaminyl-L-alpha-aspartyl-O-sulfo-L-tyrosyl-L-threonylglycyl-L-tryptophyl-L-methionyl-L-alpha-aspartyl-L-phenylalaninamide; Ceruletide [USAN:INN:BAN]; 5-Oxo-L-prolyl-L-glutaminyl-L-aspartyl-L-tyrosyl-L-threonylglycyl-L-tryptophyl-L-methionyl-L-aspartylphenyl-L-alaninamide 4-(hydrogen sulfate) (ester); Ceruletidum [INN-Latin]; Ceruletida [INN-Spanish]; 5-oxo-L-prolyl-L-glutaminyl-L-a-aspartyl-O-sulfo-L-tyrosyl-L-threonylglycyl-L-tryptophyl-L-methionyl-L-a-aspartyl-L-phenylalaninamide; Ceruletidum; Ceruletide (USAN/INN); Ceruletida
IndicationPancreatic malfunction
[ICD9: 577   ICD10: K85, K86]
Approved    [1]
Structure

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InChI1S/C58H73N13O21S2/c1-29(72)49(71-57(87)40(23-31-12-14-33(15-13-31
)92-94(89,90)91)68-56(86)43(26-48(78)79)69-52(82)37(16-18-44(59)7
3)65-51(81)36-17-19-45(74)63-36)58(88)62-28-46(75)64-41(24-32-27-
61-35-11-7-6-10-34(32)35)54(84)66-38(20-21-93-2)53(83)70-42(25-47
(76)77)55(85)67-39(50(60)80)22-30-8-4-3-5-9-30/h3-15,27,29,36-43,
49,61,72H,16-26,28H2,1-2H3,(H2,59,73)(H2,60,80)(H,62,88)(H,63,74)
(H,64,75)(H,65,81)(H,66,84)(H,67,85)(H,68,86)(H,69,82)(H,70,83)(H
,71,87)(H,76,77)(H,78,79)(H,89,90,91)/t29-,36+,37+,38+,39+,40+,41
+,42+,43+,49+/m1/s1
InChIKeyYRALAIOMGQZKOW-HYAOXDFASA-N
Canonical SMILESCC(C(C(=O)NCC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(CCSC)C(=O)NC(CC(=O)O)C(=
O)NC(CC3=CC=CC=C3)C(=O)N)NC(=O)C(CC4=CC=C(C=C4)OS(=O)(=O)O)NC(=O)C(CC(=
O)O)NC(=O)C(CCC(=O)N)NC(=O)C5CCC(=O)N5)O    
Isomeric SMILESC[C@H]([C@@H](C(=O)NCC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)N[C@@H](CCSC)C
(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N)NC(=O)[C@H](CC4=CC=
C(C=C4)OS(=O)(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@@H]
5CCC(=O)N5)O
Therapeutic ClassDiagnostic Agents
CAS NumberCAS 17650-98-5
FormulaC45H57N9O14S
PubChem Compound IDCID 16129675.
PubChem Substance IDSID 171112.
SuperDrug ATC IDV04CC04
SuperDrug CAS ID017650985;
TargetCholecystokinin receptorAgonist[2]
Ref 1Drug information of Ceruletide, 2008 To Reference
Ref 2Comparison of postprandial and ceruletide serum bile acid stimulation in dogs. J Vet Intern Med. 2008 Jul-Aug;22(4):873-8. To Reference



 

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