In-Silico Structure database (LMISSD)
| |
LM ID | LMGP05029AAF |
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Common Name | PGP(O-14:0/14:1(9Z)) |
Systematic Name | 1-tetradecyl-2-(9Z-tetradecenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol-3'- phosphate) |
Synonyms | PGP(O-28:1); PGP(O-14:0/14:1) |
Exact Mass | |
Formula | C34H68O12P2 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoglycerophosphates [GP05] |
Sub Class | 1-alkyl,2-acylglycerophosphoglycerophosphates [GP0502] |
PubChem Compound ID (CID) | - |
InChIKey | QABBCACJAOAJKN-DIBQBJQOSA-N |
InChI | InChI=1S/C34H68O12P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-42-30-33(31-45-48(40, 41)44-29-32(35)28-43-47(37,38)39)46-34(36)26-24-22-20-18-16-14-12-10-8-6-4-2/h10 ,12,32-33,35H,3-9,11,13-31H2,1-2H3,(H,40,41)(H2,37,38,39)/b12-10-/t32-,33+/m0/s1 |
SMILES | [C@]([H])(OC(CCCCCCC/C=C\CCCC)=O)(COP(=O)(O)OC[C@@]([H])(O)COP(O)(O)=O)COCCCCCCC CCCCCCC |
MS Spectra | - |
Status | Active (generated by computational methods) |