Drug Information
Drug General Information | |||||
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Drug ID |
D0I9ME
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Former ID |
DNC004744
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Drug Name |
Des-AA1,2,5-[D-Trp8,(NalphaMe)IAmp9,Tyr11]SRIF
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Indication | Discovery agent | Investigative | [527384] | ||
Structure |
Download2D MOL |
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Formula |
C75H98N14O16S2
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Canonical SMILES |
CC(C)NCC1=CC=C(C=C1)CC2C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(<br />C(=O)NC(CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N2C)<br />CC3=CNC4=CC=CC=C43)CC5=CC=CC=C5)CC6=CC=CC=C6)CCCCN)N)C(<br />=O)O)CO)C(C)O)CC7=CC=C(C=C7)O)C(C)O
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InChI |
1S/C75H98N14O16S2/c1-42(2)78-37-49-25-23-48(24-26-49)35-62-71(100)88-64(44(4)92)72(101)83-58(34-47-27-29-51(93)30-28-47)69(98)87-63(43(3)91)73(102)85-60(39-90)70(99)86-61(75(104)105)41-107-106-40-53(77)65(94)80-55(22-14-15-31-76)66(95)81-56(32-45-16-8-6-9-17-45)67(96)82-57(33-46-18-10-7-11-19-46)68(97)84-59(74(103)89(62)5)36-50-38-79-54-21-13-12-20-52(50)54/h6-13,16-21,23-30,38,42-44,53,55-64,78-79,90-93H,14-15,22,31-37,39-41,76-77H2,1-5H3,(H,80,94)(H,81,95)(H,82,96)(H,83,101)(H,84,97)(H,85,102)(H,86,99)(H,87,98)(H,88,100)(H,104,105)/t43-,44-,53-,55-,56-,57+,58+,59+,60+,61+,62+,63-,64-/m1/s1
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InChIKey |
HLFGUCDHVNBZCJ-SQPHWWHVSA-N
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PubChem Compound ID | |||||
Target and Pathway | |||||
Target(s) | Somatostatin receptor 1 | Target Info | Inhibitor | [527384] | |
References |
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