In-Silico Structure database (LMISSD)
| |
LM ID | LMSP03039AAH |
---|---|
Common Name | PI-Cer(d14:0/13:0) |
Systematic Name | N-(tridecanoyl)-tetradecasphinganine-1-phospho-(1'-myo-inositol) |
Synonyms | - |
Exact Mass | |
Formula | C33H66NO11P |
Category | Sphingolipids [SP] |
Main Class | Phosphosphingolipids [SP03] |
Sub Class | Ceramide phosphoinositols [SP0303] |
PubChem Compound ID (CID) | - |
InChIKey | YMXRJPNKXZWWFO-LBGZRMJRSA-N |
InChI | InChI=1S/C33H66NO11P/c1-3-5-7-9-11-13-15-17-19-21-23-27(36)34-25(26(35)22-20-18- 16-14-12-10-8-6-4-2)24-44-46(42,43)45-33-31(40)29(38)28(37)30(39)32(33)41/h25-26 ,28-33,35,37-41H,3-24H2,1-2H3,(H,34,36)(H,42,43)/t25-,26+,28?,29+,30?,31?,32?,33 +/m0/s1 |
SMILES | [C@](COP(=O)(O)O[C@@H]1C(O)[C@H](O)C(O)C(O)C1O)([H])(NC(CCCCCCCCCCCC)=O)[C@]([H] )(O)CCCCCCCCCCC |
MS Spectra | - |
Status | Active (generated by computational methods) |