In-Silico Structure database (LMISSD)
| |
LM ID | LMSP02039AD3 |
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Common Name | Cer(t15:0/18:1(9Z)) |
Systematic Name | N-(9Z-octadecenoyl)-4R-hydroxypentadecasphinganine |
Synonyms | - |
Exact Mass | |
Formula | C33H65NO4 |
Category | Sphingolipids [SP] |
Main Class | Ceramides [SP02] |
Sub Class | N-acyl-4-hydroxysphinganines (phytoceramides) [SP0203] |
PubChem Compound ID (CID) | - |
InChIKey | HKGFHYKBFFJBIJ-DBQIYCCASA-N |
InChI | InChI=1S/C33H65NO4/c1-3-5-7-9-11-13-14-15-16-17-18-20-22-24-26-28-32(37)34-30(29 -35)33(38)31(36)27-25-23-21-19-12-10-8-6-4-2/h15-16,30-31,33,35-36,38H,3-14,17-2 9H2,1-2H3,(H,34,37)/b16-15-/t30-,31+,33-/m0/s1 |
SMILES | [C@](CO)([H])(NC(CCCCCCC/C=C\CCCCCCCC)=O)[C@]([H])(O)[C@H](O)CCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M-H]-) |
Status | Active (generated by computational methods) |