CASPASE-9, HUMAN, INTERMEDIATE1

CAS号
CCD编号
CCD00424503
分子式
C69 H120 N30 O27
分子量
1801.89

基本信息

产品名称: CASPASE-9, HUMAN, INTERMEDIATE1
英文同义词: CASPASE-9, HUMAN, INTERMEDIATE1 ; EDIQRAGSGSRRDQAR
MDL号: MFCD03844546
氢键受体数量: 57
氢键供体数量: 36
Smile: CC[C@H](C)[C@@H](C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)NC(CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)N
InChi: InChI=1S/C69H120N30O27/c1-5-30(2)51(99-62(122)41(25-50(110)111)97-54(114)33(70)14-19-48(106)107)64(124)95-38(16-18-45(72)103)60(120)91-34(10-6-20-81-66(73)74)56(116)87-31(3)52(112)85-26-46(104)89-42(28-100)55(115)86-27-47(105)90-43(29-101)63(123)93-35(11-7-21-82-67(75)76)58(118)92-36(12-8-22-83-68(77)78)59(119)98-40(24-49(108)109)61(121)94-37(15-17-44(71)102)57(117)88-32(4)53(113)96-39(65(125)126)13-9-23-84-69(79)80/h30-43,51,100-101H,5-29,70H2,1-4H3,(H2,71,102)(H2,72,103)(H,85,112)(H,86,115)(H,87,116)(H,88,117)(H,89,104)(H,90,105)(H,91,120)(H,92,118)(H,93,123)(H,94,121)(H,95,124)(H,96,113)(H,97,114)(H,98,119)(H,99,122)(H,106,107)(H,108,109)(H,110,111)(H,125,126)(H4,73,74,81)(H4,75,76,82)(H4,77,78,83)(H4,79,80,84)/t30-,31-,32-,33-,34-,35?,36-,37-,38-,39-,40-,41-,42-,43-,51-/m0/s1
InChiKey: InChIKey=ZLCXCCHUZCMIHS-HEHIQKNKSA-N

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