In-Silico Structure database (LMISSD)
| |
LM ID | LMSP03039AJB |
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Common Name | PI-Cer(d14:2(4E,6E)/15:1(9Z)) |
Systematic Name | N-(9Z-pentadecenoyl)-4E,6E-tetradecasphingadienine-1-phospho-(1'-myo-inositol) |
Synonyms | - |
Exact Mass | |
Formula | C35H64NO11P |
Category | Sphingolipids [SP] |
Main Class | Phosphosphingolipids [SP03] |
Sub Class | Ceramide phosphoinositols [SP0303] |
PubChem Compound ID (CID) | - |
InChIKey | VKERNHLQPTXCEO-PTSYKRMKSA-N |
InChI | InChI=1S/C35H64NO11P/c1-3-5-7-9-11-13-14-15-17-19-21-23-25-29(38)36-27(28(37)24- 22-20-18-16-12-10-8-6-4-2)26-46-48(44,45)47-35-33(42)31(40)30(39)32(41)34(35)43/ h11,13,18,20,22,24,27-28,30-35,37,39-43H,3-10,12,14-17,19,21,23,25-26H2,1-2H3,(H ,36,38)(H,44,45)/b13-11-,20-18+,24-22+/t27-,28+,30?,31+,32?,33?,34?,35+/m0/s1 |
SMILES | [C@](COP(=O)(O)O[C@@H]1C(O)[C@H](O)C(O)C(O)C1O)([H])(NC(CCCCCCC/C=C\CCCCC)=O)[C@ ]([H])(O)/C=C/C=C/CCCCCCC |
MS Spectra | - |
Status | Active (generated by computational methods) |