In-Silico Structure Database (LMISSD)
Common Name
LPIP3[3',4',5'](34:0/0:0)
Systematic Name
1-tetratriacontanoyl-sn-glycero-3-phosphoinositol-3,4,5-trisphosphate
LM ID
LMGP09049ACF
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1064.476867
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoinositol trisphosphates [GP09]
Monoacylglycerophosphoinositol trisphosphates [GP0904]
String Representations
InChiKey (Click to copy)
OORCEWDLDCYFRQ-KIMIJIAESA-N
InChi (Click to copy)
InChI=1S/C43H88O21P4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-37(45)59-34-36(44)35-60-68(57,58)64-40-38(46)41(61-65(48,49)50)43(63-67(54,55)56)42(39(40)47)62-66(51,52)53/h36,38-44,46-47H,2-35H2,1H3,(H,57,58)(H2,48,49,50)(H2,51,52,53)(H2,54,55,56)/t36-,38?,39?,40-,41+,42?,43?/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(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O