13S-HYDROXY-9Z,11E-OCTADECADIENOIC ACID,CHOLESTERYL ESTER

CAS号
CCD编号
CCD00100330
分子式
C45 H76 O3
分子量
665.092

基本信息

产品名称: 13S-HYDROXY-9Z,11E-OCTADECADIENOIC ACID,CHOLESTERYL ESTER
英文同义词: 13(S)-HODE CHOLESTERYL ESTER ; 13S-HYDROXY-9Z,11E-OCTADECADIENOIC ACID,CHOLESTERYL ESTER
MDL号: MFCD00216104
氢键受体数量: 3
氢键供体数量: 1
Smile: CCCCC[C@@H](/C=C/C=C\CCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C)O
InChi: InChI=1S/C45H76O3/c1-7-8-16-22-37(46)23-17-14-12-10-9-11-13-15-18-24-43(47)48-38-29-31-44(5)36(33-38)25-26-39-41-28-27-40(35(4)21-19-20-34(2)3)45(41,6)32-30-42(39)44/h12,14,17,23,25,34-35,37-42,46H,7-11,13,15-16,18-22,24,26-33H2,1-6H3/b14-12-,23-17+/t35-,37+,38+,39+,40-,41+,42+,44+,45-/m1/s1
InChiKey: InChIKey=RZXYPSUQZUUHPD-XFIJILBJSA-N

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