In-Silico Structure database (LMISSD)
| |
LM ID | LMGP08029A83 |
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Common Name | PIP2[3',5'](O-14:0/16:0) |
Systematic Name | 1-tetradecyl-2-hexadecanoyl-sn-glycero-3-phosphoinositol-3,5-bisphosphate |
Synonyms | PIP2[3',5'](O-30:0); PIP2(O-14:0_16:0) |
Exact Mass | |
Formula | C39H79O18P3 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoinositol bisphosphates [GP08] |
Sub Class | 1-alkyl,2-acylglycerophosphoinositol bisphosphates [GP0802] |
PubChem Compound ID (CID) | - |
InChIKey | MFHBCPVIYFQNMO-QHYDAVLGSA-N |
InChI | InChI=1S/C39H79O18P3/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-33(40)54-32(30-52- 29-27-25-23-21-19-16-14-12-10-8-6-4-2)31-53-60(50,51)57-39-35(42)37(55-58(44,45) 46)34(41)38(36(39)43)56-59(47,48)49/h32,34-39,41-43H,3-31H2,1-2H3,(H,50,51)(H2,4 4,45,46)(H2,47,48,49)/t32-,34?,35?,36?,37-,38?,39-/m1/s1 |
SMILES | [C@]([H])(OC(CCCCCCCCCCCCCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](OP(O)(=O)O)C(O)C(OP (=O)(O)O)C1O)COCCCCCCCCCCCCCC |
MS Spectra | - |
Status | Active (generated by computational methods) |