In-Silico Structure database (LMISSD)
| |
LM ID | LMGP08049AA4 |
---|---|
Common Name | LPIP2[3',4'](18:3(6Z,9Z,12Z)/0:0) |
Systematic Name | 1-(6Z,9Z,12Z-octadecatrienoyl)-sn-glycero-3-phosphoinositol-3,4-bisphosphate |
Synonyms | - |
Exact Mass | |
Formula | C27H49O18P3 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoinositol bisphosphates [GP08] |
Sub Class | Monoacylglycerophosphoinositol bisphosphates [GP0804] |
PubChem Compound ID (CID) | - |
InChIKey | DOJFVYMDECFMRS-WPIKLTEDSA-N |
InChI | InChI=1S/C27H49O18P3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(29)41-18-20(2 8)19-42-48(39,40)45-25-22(30)23(31)26(43-46(33,34)35)27(24(25)32)44-47(36,37)38/ h6-7,9-10,12-13,20,22-28,30-32H,2-5,8,11,14-19H2,1H3,(H,39,40)(H2,33,34,35)(H2,3 6,37,38)/b7-6-,10-9-,13-12-/t20-,22?,23?,24?,25+,26?,27+/m1/s1 |
SMILES | [C@]([H])(O)(COP(=O)(O)O[C@@H]1C(O)[C@H](OP(O)(=O)O)C(OP(=O)(O)O)C(O)C1O)COC(CCC C/C=CC/C=CC/C=CCCCCC)=O |
MS Spectra | - |
Status | Active (generated by computational methods) |