In-Silico Structure database (LMISSD)
| |
LM ID | LMSP02059BYS |
---|---|
Common Name | CerP(d18:1(4E)/34:0) |
Systematic Name | N-(tetratriacontanoyl)-4E-sphingenine-1-phosphate |
Synonyms | - |
Exact Mass | |
Formula | C52H104NO6P |
Category | Sphingolipids [SP] |
Main Class | Ceramides [SP02] |
Sub Class | Ceramide 1-phosphates [SP0205] |
PubChem Compound ID (CID) | - |
InChIKey | UKJSNKQGGDWULW-LBVNOBLISA-N |
InChI | InChI=1S/C52H104NO6P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-27-28-29- 30-31-32-33-34-36-38-40-42-44-46-48-52(55)53-50(49-59-60(56,57)58)51(54)47-45-43 -41-39-37-35-16-14-12-10-8-6-4-2/h45,47,50-51,54H,3-44,46,48-49H2,1-2H3,(H,53,55 )(H2,56,57,58)/b47-45+/t50-,51+/m0/s1 |
SMILES | [C@](COP(=O)(O)O)([H])(NC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)[C@]([H])(O)/C=C/ CCCCCCCCCCCCC |
MS Spectra | - |
Status | Active (generated by computational methods) |