In-Silico Structure database (LMISSD)
| |
LM ID | LMGL0304AR91 |
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Common Name | TG(P-22:0/11:0/12:0) |
Systematic Name | 1-(1Z-docosenyl)-2-undecanoyl-3-dodecanoyl-sn-glycerol |
Synonyms | TG(P-45:0); TG(P-22:0_11:0_12:0) |
Exact Mass | |
Formula | C48H92O5 |
Category | Glycerolipids [GL] |
Main Class | Triradylglycerols [GL03] |
Sub Class | 1Z-alkenyldiacylglycerols [GL0304] |
PubChem Compound ID (CID) | - |
InChIKey | QHRJJNKEMZPJML-OENHAXBHSA-N |
InChI | InChI=1S/C48H92O5/c1-4-7-10-13-16-19-20-21-22-23-24-25-26-27-28-29-31-34-37-40-4 3-51-44-46(53-48(50)42-39-36-32-18-15-12-9-6-3)45-52-47(49)41-38-35-33-30-17-14- 11-8-5-2/h40,43,46H,4-39,41-42,44-45H2,1-3H3/b43-40-/t46-/m1/s1 |
SMILES | C(OC(=O)CCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCC)=O)CO/C=C\CCCCCCCCCCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M+NH4]+) |
Status | Active (generated by computational methods) |