[LYS5(BOC)]OCTREOTATE ACETATE ,133304-78-6

[LYS5(BOC)]OCTREOTATE ACETATE

Basic Information
Product Name：	[LYS5(BOC)]OCTREOTATE ACETATE
CAS：	133304-78-6
English Synonyms：	[LYS5(BOC)]OCTREOTATE ACETATE
MDL Number.：	MFCD20134076
H bond acceptor：	23
H bond donor：	13
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)Cc4ccccc4)NC(=O)[C@@H](Cc5ccccc5)N)C(=O)N[C@@H]([C@@H](C)O)C(=O)O)O.CC(=O)O
InChi：	InChI=1S/C54H72N10O13S2.C2H4O2/c1-30(65)43-51(73)62-42(50(72)64-44(31(2)66)52(74)75)29-79-78-28-41(61-45(67)36(55)24-32-16-8-6-9-17-32)49(71)59-39(25-33-18-10-7-11-19-33)47(69)60-40(26-34-27-57-37-21-13-12-20-35(34)37)48(70)58-38(46(68)63-43)22-14-15-23-56-53(76)77-54(3,4)5;1-2(3)4/h6-13,16-21,27,30-31,36,38-44,57,65-66H,14-15,22-26,28-29,55H2,1-5H3,(H,56,76)(H,58,70)(H,59,71)(H,60,69)(H,61,67)(H,62,73)(H,63,68)(H,64,72)(H,74,75);1H3,(H,3,4)/t30-,31-,36-,38+,39+,40-,41+,42+,43+,44+;/m1./s1
InChiKey：	InChIKey=QESDLROKVHGEAW-AIPIEGNOSA-N

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