PIP2(16:0/18:1(9Z)),小分子代谢物

PIP2(16:0/18:1(9Z))

SMPDB_ID

SMP0000463

通道名称

Phosphatidylinositol Phosphate Metabolism

通路

Metabolic

代谢物ID

PW_C006078

CAS号

公式

C43H83O19P3

HMDB_ID

HMDB0010037

KEGG_ID

C00626

ChEBI_ID

DrugBank_ID

IUPAC

{[(4S,6S)-4-({[(2R)-3-(hexadecanoyloxy)-2-[(9Z)-octadec-9-enoyloxy]propoxy](hydroxy)phosphoryl}oxy)-2,3,5-trihydroxy-6-(phosphonooxy)cyclohexyl]oxy}phosphonic acid

微笑

CCCCCCCCCCCCCCCC(=O)OC[C@]([H])(COP(O)(=O)O[C@H]1C(O)C(O)C(OP(=O)(O)O)[C@@H](OP(=O)(O)O)C1O)OC(=O)CCCCCCC\C=C/CCCCCCCC

InChI

InChI=1S/C43H83O19P3/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-37(45)59-35(33-57-36(44)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2)34-58-65(55,56)62-41-38(46)39(47)42(60-63(49,50)51)43(40(41)48)61-64(52,53)54/h17-18,35,38-43,46-48H,3-16,19-34H2,1-2H3,(H,55,56)(H2,49,50,51)(H2,52,53,54)/b18-17-/t35-,38?,39?,40?,41+,42?,43+/m1/s1

InChI关键

IQWUGLVLOWHAIC-YXSWCGMVSA-N