In-Silico Structure Database (LMISSD)
Common Name
PI(10:0/17:0)
Systematic Name
1-decanoyl-2-heptadecanoyl-sn-glycero-3-phosphoinositol
LM ID
LMGP06019AAL
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
740.447583
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoinositols [GP06]
Diacylglycerophosphoinositols [GP0601]
String Representations
InChiKey (Click to copy)
SCCADVWLWMRZAJ-MWLHZSNFSA-N
InChi (Click to copy)
InChI=1S/C36H69O13P/c1-3-5-7-9-11-12-13-14-15-16-17-19-21-23-25-30(38)48-28(26-46-29(37)24-22-20-18-10-8-6-4-2)27-47-50(44,45)49-36-34(42)32(40)31(39)33(41)35(36)43/h28,31-36,39-43H,3-27H2,1-2H3,(H,44,45)/t28-,31?,32-,33?,34?,35?,36-/m1/s1
SMILES (Click to copy)
[C@]([H])(OC(CCCCCCCCCCCCCCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](O)C(O)C(O)C1O)COC(CCCCCCCCC)=O