[TYR3,LYS5(BOC)]OCTREOTIDE ACETATE ,147790-89-4

[TYR3,LYS5(BOC)]OCTREOTIDE ACETATE

基本信息
产品名称：	[TYR3,LYS5(BOC)]OCTREOTIDE ACETATE
CAS：	147790-89-4
英文同义词：	[TYR3,LYS5(BOC)]OCTREOTIDE ACETATE
MDL号：	MFCD20134075
氢键受体数量：	23
氢键供体数量：	14
Smile：	C[C@H]([C@H]1C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N1)CCCCNC(=O)OC(C)(C)C)Cc2c[nH]c3c2cccc3)Cc4ccc(cc4)O)NC(=O)[C@@H](Cc5ccccc5)N)C(=O)N[C@H](CO)[C@@H](C)O)O.CC(=O)O
InChi：	InChI=1S/C54H74N10O13S2.C2H4O2/c1-30(66)42(27-65)61-51(74)44-29-79-78-28-43(62-46(69)37(55)23-32-13-7-6-8-14-32)50(73)59-40(24-33-18-20-35(68)21-19-33)48(71)60-41(25-34-26-57-38-16-10-9-15-36(34)38)49(72)58-39(47(70)64-45(31(2)67)52(75)63-44)17-11-12-22-56-53(76)77-54(3,4)5;1-2(3)4/h6-10,13-16,18-21,26,30-31,37,39-45,57,65-68H,11-12,17,22-25,27-29,55H2,1-5H3,(H,56,76)(H,58,72)(H,59,73)(H,60,71)(H,61,74)(H,62,69)(H,63,75)(H,64,70);1H3,(H,3,4)/t30-,31-,37-,39+,40+,41-,42-,43+,44+,45+;/m1./s1
InChiKey：	InChIKey=WGPKTGMWJFTUTH-UDANNROWSA-N

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