In-Silico Structure database (LMISSD)
| |
LM ID | LMGP05039DDS |
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Common Name | PGP(P-14:0/17:2(9Z,12Z)) |
Systematic Name | 1-(1Z-tetradecenyl)-2-(9Z,12Z-heptadecadienoyl)-sn-glycero-3-phospho-(1'-sn- glycerol-3'-phosphate) |
Synonyms | PGP(P-31:2); PGP(P-14:0/17:2) |
Exact Mass | |
Formula | C37H70O12P2 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoglycerophosphates [GP05] |
Sub Class | 1-(1Z-alkenyl),2-acylglycerophosphoglycerophosphates [GP0503] |
PubChem Compound ID (CID) | - |
InChIKey | XTJXLXOTIZVYJQ-ZARXGUMTSA-N |
InChI | InChI=1S/C37H70O12P2/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-37(39)49-36(34- 48-51(43,44)47-32-35(38)31-46-50(40,41)42)33-45-30-28-26-24-22-20-16-14-12-10-8- 6-4-2/h9,11,15,17,28,30,35-36,38H,3-8,10,12-14,16,18-27,29,31-34H2,1-2H3,(H,43,4 4)(H2,40,41,42)/b11-9-,17-15-,30-28-/t35-,36+/m0/s1 |
SMILES | [C@]([H])(OC(CCCCCCC/C=C\C/C=C\CCCC)=O)(COP(=O)(O)OC[C@@]([H])(O)COP(O)(O)=O)CO/ C=C\CCCCCCCCCCCC |
MS Spectra | - |
Status | Active (generated by computational methods) |