In-Silico Structure database (LMISSD)
| |
LM ID | LMGP12019FKU |
---|---|
Common Name | CL(1'-[14:1(9Z)/14:0],3'-[14:0/14:1(9Z)]) |
Systematic Name | 1'-[1-(9Z-tetradecenoyl)-2-tetradecanoyl-sn-glycero-3-phospho],3'-[1- tetradecanoyl-2-(9Z-tetradecenoyl)-sn-glycero-3-phospho]-sn-glycerol |
Synonyms | CL(56:2); CL(14:0_14:0_14:1_14:1) |
Exact Mass | |
Formula | C65H122O17P2 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoglycerophosphoglycerols [GP12] |
Sub Class | Diacylglycerophosphoglycerophosphodiradylglycerols [GP1201] |
PubChem Compound ID (CID) | - |
InChIKey | FDVAKCOVRNPLMT-FWOSEMONSA-N |
InChI | InChI=1S/C65H122O17P2/c1-5-9-13-17-21-25-29-33-37-41-45-49-62(67)75-55-60(81-64( 69)51-47-43-39-35-31-27-23-19-15-11-7-3)57-79-83(71,72)77-53-59(66)54-78-84(73,7 4)80-58-61(82-65(70)52-48-44-40-36-32-28-24-20-16-12-8-4)56-76-63(68)50-46-42-38 -34-30-26-22-18-14-10-6-2/h17,20-21,24,59-61,66H,5-16,18-19,22-23,25-58H2,1-4H3, (H,71,72)(H,73,74)/b21-17-,24-20-/t59-,60-,61-/m1/s1 |
SMILES | P(OC[C@]([H])(OC(CCCCCCCCCCCCC)=O)COC(CCCCCCC/C=C\CCCC)=O)(O)(OC[C@](O)([H])COP( OC[C@]([H])(OC(=O)CCCCCCC/C=C\CCCC)COC(=O)CCCCCCCCCCCCC)(O)=O)=O |
MS Spectra | - |
Status | Active (generated by computational methods) |