BIOTIN-LC-G-SUBTIDE_化学云数据库

BIOTIN-LC-G-SUBTIDE

基本信息
产品名称：	BIOTIN-LC-G-SUBTIDE
英文同义词：	BIOTIN-LC-G-SUBTIDE ; BIOTIN-LC-PROTEIN KINASE G SUBSTRATE
MDL号：	MFCD17018904
氢键受体数量：	43
氢键供体数量：	26
Smile：	C[C@H]([C@@H](C(=O)N1CCC[C@H]1C(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N)NC(=O)CCCCCNC(=O)CCCC[C@H]3[C@@H]4[C@H](CS3)NC(=O)N4)O
InChi：	InChI=1S/C69H121N25O18S/c1-38(95)54(64(109)94-35-15-22-48(94)65(110)111)91-61(106)45(36-53(99)100)89-59(104)40(17-7-9-29-71)84-56(101)41(18-11-31-80-66(73)74)86-57(102)42(19-12-32-81-67(75)76)87-62(107)47-21-14-34-93(47)63(108)44(20-13-33-82-68(77)78)88-58(103)39(16-6-8-28-70)85-60(105)43(26-27-50(72)96)83-52(98)25-3-2-10-30-79-51(97)24-5-4-23-49-55-46(37-113-49)90-69(112)92-55/h38-49,54-55,95H,2-37,70-71H2,1H3,(H2,72,96)(H,79,97)(H,83,98)(H,84,101)(H,85,105)(H,86,102)(H,87,107)(H,88,103)(H,89,104)(H,91,106)(H,99,100)(H,110,111)(H4,73,74,80)(H4,75,76,81)(H4,77,78,82)(H2,90,92,112)/t38-,39+,40+,41+,42+,43+,44+,45+,46+,47+,48+,49+,54+,55+/m1/s1
InChiKey：	InChIKey=ISMMRBPMAQZWLA-SIHHXCGMSA-N

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