| Chemical & Physical Properties | |
|---|---|
| CAS Number | 138661-02-6 |
| Catalog No. | 2A-3175149 |
| Chinese Name | 喷曲肽 |
| Synonyms | Pentreotide; [DTPA-D-Phe1]octreotide; Unii-G083B71p98; DTPA-octreotide; DTPA-SMS |
| Molecular Formula | C63H87N13O19S2 |
| Molecular Weight | 1380.54000 |
| Application | Pentetreotide is the DTPA conjugate of Octreotide. Pentetreotide is an indium-labeled somatostatin analog for use in nuclear medicine imaging. Pentetreotide and somatostatin receptor scintigraphy are |
| SMILES | CC(O)C(CO)NC(=O)C1CSSCC(NC(=O)C(Cc2ccccc2)NC(=O)CN(CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)CC(=O)O)C(=O)NC(Cc2ccccc2)C(=O)NC(Cc2c[nH]c3ccccc23)C(=O)NC(CCCCN)C(=O)NC(C(C)O)C(=O)N1 |
| InChI | InChI=1S/C63H87N13O19S2/c1-37(78)48(34-77)70-62(94)50-36-97-96-35-49(71-58(90)45(25-39-13-5-3-6-14-39)66-51(80)29-75(31-53(83)84)23-21-74(30-52(81)82)22-24-76(32-54(85)86)33-55(87)88)61(93)68-46(26-40-15-7-4-8-16-40)59(91)69-47(27-41-28-65-43-18-10-9-17-42(41)43)60(92)67-44(19-11-12-20-64)57(89)73-56(38(2)79)63(95)72-50/h3-10,13-18,28,37-38,44-50,56,65,77-79H,11-12,19-27,29-36,64H2,1-2H3,(H,66,80)(H,67,92)(H,68,93)(H,69,91)(H,70,94)(H,71,90)(H,72,95)(H,73,89)(H,81,82)(H,83,84)(H,85,86)(H,87,88) |
| InChI Key | CNLWNYCFDMAZCB-VYCOIWHESA-N |
| Transport Info | Product Name: Pentetreotide |
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