In-Silico Structure database (LMISSD)
| |
LM ID | LMGP08039A6K |
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Common Name | PIP2[3',5'](P-16:1(9Z)/10:0) |
Systematic Name | 1-(1Z,9Z-hexadecadienyl)-2-decanoyl-sn-glycero-3-phosphoinositol-3,5- bisphosphate |
Synonyms | PIP2[3',5'](P-26:1); PIP2(P-16:1_10:0) |
Exact Mass | |
Formula | C35H67O18P3 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoinositol bisphosphates [GP08] |
Sub Class | 1-(1Z-alkenyl),2-acylglycerophosphoinositol bisphosphates [GP0803] |
PubChem Compound ID (CID) | - |
InChIKey | UJEFUMFPOSCOEO-FUCLDSNCSA-N |
InChI | InChI=1S/C35H67O18P3/c1-3-5-7-9-11-12-13-14-15-16-17-19-21-23-25-48-26-28(50-29( 36)24-22-20-18-10-8-6-4-2)27-49-56(46,47)53-35-31(38)33(51-54(40,41)42)30(37)34( 32(35)39)52-55(43,44)45/h12-13,23,25,28,30-35,37-39H,3-11,14-22,24,26-27H2,1-2H3 ,(H,46,47)(H2,40,41,42)(H2,43,44,45)/b13-12-,25-23-/t28-,30?,31?,32?,33-,34?,35- /m1/s1 |
SMILES | [C@]([H])(OC(CCCCCCCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](OP(O)(=O)O)C(O)C(OP(=O)(O )O)C1O)CO/C=C\CCCCCC/C=C\CCCCCC |
MS Spectra | - |
Status | Active (generated by computational methods) |