In-Silico Structure Database (LMISSD)
Common Name
LPIP3[3',4',5'](33:0/0:0)
Systematic Name
1-tritriacontanoyl-sn-glycero-3-phosphoinositol-3,4,5-trisphosphate
LM ID
LMGP09049ACE
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1050.461217
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoinositol trisphosphates [GP09]
Monoacylglycerophosphoinositol trisphosphates [GP0904]
String Representations
InChiKey (Click to copy)
LFADUAFVIITIMM-RZAFEBSPSA-N
InChi (Click to copy)
InChI=1S/C42H86O21P4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-36(44)58-33-35(43)34-59-67(56,57)63-39-37(45)40(60-64(47,48)49)42(62-66(53,54)55)41(38(39)46)61-65(50,51)52/h35,37-43,45-46H,2-34H2,1H3,(H,56,57)(H2,47,48,49)(H2,50,51,52)(H2,53,54,55)/t35-,37?,38?,39-,40+,41?,42?/m1/s1
SMILES (Click to copy)
[C@]([H])(O)(COP(=O)(O)O[C@@H]1C(O)[C@H](OP(O)(=O)O)C(OP(=O)(O)O)C(OP(=O)(O)O)C1O)COC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O