GANGLIOSIDE GM1 (OVINE BRAIN) AMMONIUM SALT

CAS号
383908-09-6
CCD编号
CCD07395628
分子式
C73 H131 N3 O31 . H3 N
分子量
1563.86

基本信息

产品名称: GANGLIOSIDE GM1 (OVINE BRAIN) AMMONIUM SALT
CAS: 383908-09-6
英文同义词: GM1 GANGLIOSIDE (BRAIN, OVINE-AMMONIUM SALT) ; GANGLIOSIDE GM1 (OVINE BRAIN) AMMONIUM SALT
MDL号: MFCD22416662
氢键受体数量: 34
氢键供体数量: 20
Smile: CCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O)NC(=O)C)O[C@@]5(C[C@@H]([C@H]([C@@H](O5)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)O)O)[C@@H](/C=C/CCCCCCCCCCCCC)O.N
InChi: InChI=1S/C73H131N3O31.H3N/c1-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-52(87)76-44(45(84)33-31-29-27-25-23-21-18-16-14-12-10-8-6-2)41-98-69-61(94)59(92)63(50(39-80)101-69)103-71-62(95)67(107-73(72(96)97)35-46(85)53(74-42(3)82)66(106-73)55(88)47(86)36-77)64(51(40-81)102-71)104-68-54(75-43(4)83)65(57(90)49(38-79)99-68)105-70-60(93)58(91)56(89)48(37-78)100-70;/h31,33,44-51,53-71,77-81,84-86,88-95H,5-30,32,34-41H2,1-4H3,(H,74,82)(H,75,83)(H,76,87)(H,96,97);1H3/b33-31+;/t44-,45+,46-,47+,48+,49+,50+,51+,53+,54+,55+,56-,57-,58-,59+,60+,61+,62+,63+,64-,65+,66+,67+,68-,69+,70-,71-,73-;/m0./s1
InChiKey: InChIKey=XKTKEUMFELHBSG-POYTVKKJSA-N

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