PIP(18:1(9Z)/16:0),小分子代谢物

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

SMPDB_ID

SMP0000463

通道名称

Phosphatidylinositol Phosphate Metabolism

通路

Metabolic

代谢物ID

PW_C006015

CAS号

公式

C43H82O16P2

HMDB_ID

HMDB0009970

KEGG_ID

C00626

ChEBI_ID

DrugBank_ID

IUPAC

{[(1R,3S)-3-({[(2R)-2-(hexadecanoyloxy)-3-[(9Z)-octadec-9-enoyloxy]propoxy](hydroxy)phosphoryl}oxy)-2,4,5,6-tetrahydroxycyclohexyl]oxy}phosphonic acid

微笑

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

InChI

InChI=1S/C43H82O16P2/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-36(44)55-33-35(57-37(45)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2)34-56-61(53,54)59-43-40(48)38(46)39(47)42(41(43)49)58-60(50,51)52/h17-18,35,38-43,46-49H,3-16,19-34H2,1-2H3,(H,53,54)(H2,50,51,52)/b18-17-/t35-,38?,39?,40?,41?,42-,43+/m1/s1

InChI关键

HMCNHIZVSBCVJX-IIOIPOTESA-N