In-Silico Structure database (LMISSD)
| |
LM ID | LMGP05029AE5 |
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Common Name | PGP(O-16:0/16:1(7Z)) |
Systematic Name | 1-hexadecyl-2-(7Z-hexadecenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol-3'- phosphate) |
Synonyms | PGP(O-32:1); PGP(O-16:0/16:1) |
Exact Mass | |
Formula | C38H76O12P2 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoglycerophosphates [GP05] |
Sub Class | 1-alkyl,2-acylglycerophosphoglycerophosphates [GP0502] |
PubChem Compound ID (CID) | - |
InChIKey | KAXZZXSJSABAOW-DDBJVOLMSA-N |
InChI | InChI=1S/C38H76O12P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-46-34-37(35-49- 52(44,45)48-33-36(39)32-47-51(41,42)43)50-38(40)30-28-26-24-22-20-18-16-14-12-10 -8-6-4-2/h18,20,36-37,39H,3-17,19,21-35H2,1-2H3,(H,44,45)(H2,41,42,43)/b20-18-/t 36-,37+/m0/s1 |
SMILES | [C@]([H])(OC(CCCCC/C=C\CCCCCCCC)=O)(COP(=O)(O)OC[C@@]([H])(O)COP(O)(O)=O)COCCCCC CCCCCCCCCCC |
MS Spectra | - |
Status | Active (generated by computational methods) |