In-Silico Structure database (LMISSD)
| |
LM ID | LMGP12019AAV |
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Common Name | CL(1'-[14:0/14:0],3'-[14:1(9Z)/16:0]) |
Systematic Name | 1'-[1-2-di-tetradecanoyl-sn-glycero-3-phospho],3'-[1-(9Z-tetradecenoyl)-2- hexadecanoyl-sn-glycero-3-phospho]-sn-glycerol |
Synonyms | CL(58:1); CL(14:0_14:0_14:1_16:0) |
Exact Mass | |
Formula | C67H128O17P2 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoglycerophosphoglycerols [GP12] |
Sub Class | Diacylglycerophosphoglycerophosphodiradylglycerols [GP1201] |
PubChem Compound ID (CID) | - |
InChIKey | CZELTQPSOLPJBK-ZYQZXXKZSA-N |
InChI | InChI=1S/C67H128O17P2/c1-5-9-13-17-21-25-29-30-34-38-42-46-50-54-67(72)84-63(58- 78-65(70)52-48-44-40-36-32-27-23-19-15-11-7-3)60-82-86(75,76)80-56-61(68)55-79-8 5(73,74)81-59-62(83-66(71)53-49-45-41-37-33-28-24-20-16-12-8-4)57-77-64(69)51-47 -43-39-35-31-26-22-18-14-10-6-2/h19,23,61-63,68H,5-18,20-22,24-60H2,1-4H3,(H,73, 74)(H,75,76)/b23-19-/t61-,62-,63-/m1/s1 |
SMILES | P(OC[C@]([H])(OC(CCCCCCCCCCCCC)=O)COC(CCCCCCCCCCCCC)=O)(O)(OC[C@](O)([H])COP(OC[ C@]([H])(OC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCC/C=C\CCCC)(O)=O)=O |
MS Spectra | - |
Status | Active (generated by computational methods) |