In-Silico Structure database (LMISSD)
| |
LM ID | LMSP03039AAB |
---|---|
Common Name | PI-Cer(d14:0/10:0) |
Systematic Name | N-(decanoyl)-tetradecasphinganine-1-phospho-(1'-myo-inositol) |
Synonyms | - |
Exact Mass | |
Formula | C30H60NO11P |
Category | Sphingolipids [SP] |
Main Class | Phosphosphingolipids [SP03] |
Sub Class | Ceramide phosphoinositols [SP0303] |
PubChem Compound ID (CID) | - |
InChIKey | DRIATONAMHCRNZ-PAYCBHIQSA-N |
InChI | InChI=1S/C30H60NO11P/c1-3-5-7-9-11-12-14-15-17-19-23(32)22(31-24(33)20-18-16-13- 10-8-6-4-2)21-41-43(39,40)42-30-28(37)26(35)25(34)27(36)29(30)38/h22-23,25-30,32 ,34-38H,3-21H2,1-2H3,(H,31,33)(H,39,40)/t22-,23+,25?,26+,27?,28?,29?,30+/m0/s1 |
SMILES | [C@](COP(=O)(O)O[C@@H]1C(O)[C@H](O)C(O)C(O)C1O)([H])(NC(CCCCCCCCC)=O)[C@]([H])(O )CCCCCCCCCCC |
MS Spectra | - |
Status | Active (generated by computational methods) |