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Caerulein, desulfated

Caerulein, desulfated is the desulfurated form of Caerulein. Caerulein is a decapeptide having the same five carboxyl-terminal amino acids as gastrin and cholecystokinin (CCK).

Designed for biological research and industrial applications, not intended for individual clinical or medical purposes.
Caerulein, desulfated(CAS 20994-83-6)

CAT No: R1258

CAS No:20994-83-6

Synonyms/Alias:20994-83-6;Caerulein, desulfated;Caerulein (desulfated);Caerulein, 4-desulfo-;EINECS 244-142-3;Caerulein(desulfated);KVLTWEUIUPCNAM-HYAOXDFASA-N;FC108639;Pyr-Gln-Asp-Tyr-Thr-Gly-Trp-Met-Asp-Phe-NH2; pE-QDYTGWMDF-NH2;

Custom Peptide Synthesis
cGMP Peptide
  • Registration of APIs
  • CMC information required for an IND
  • IND and NDA support
  • Drug master files (DMF) filing
M.F/Formula
C58H73N13O18S
M.W/Mr.
1272.3
Sequence
One Letter Code:XQDYTGWMDF
Three Letter Code:H-Pyr-Gln-Asp-Tyr-Thr-Gly-Trp-Met-Asp-Phe-NH2
Purity
>97% (by HPLC)
Shipping Condition
Shipped at room temperature
InChI
InChI=1S/C58H73N13O18S/c1-29(72)49(71-57(88)40(23-31-12-14-33(73)15-13-31)68-56(87)43(26-48(79)80)69-52(83)37(16-18-44(59)74)65-51(82)36-17-19-45(75)63-36)58(89)62-28-46(76)64-41(24-32-27-61-35-11-7-6-10-34(32)35)54(85)66-38(20-21-90-2)53(84)70-42(25-47(77)78)55(86)67-39(50(60)81)22-30-8-4-3-5-9-30/h3-15,27,29,36-43,49,61,72-73H,16-26,28H2,1-2H3,(H2,59,74)(H2,60,81)(H,62,89)(H,63,75)(H,64,76)(H,65,82)(H,66,85)(H,67,86)(H,68,87)(H,69,83)(H,70,84)(H,71,88)(H,77,78)(H,79,80)/t29-,36+,37+,38+,39+,40+,41+,42+,43+,49+/m1/s1
InChI Key
KVLTWEUIUPCNAM-HYAOXDFASA-N
Canonical SMILES
CC(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)O)NC(=O)C(CC(=O)O)NC(=O)C(CCC(=O)N)NC(=O)C5CCC(=O)N5)O
Isomeric SMILES
C[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)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@@H]5CCC(=O)N5)O

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