In-Silico Structure database (LMISSD)
| |
LM ID | LMSP05019AU1 |
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Common Name | GlcCer(d15:1(8E)/10:0) |
Systematic Name | N-(decanoyl)-1-β-glucosyl-8E-pentadecasphingenine |
Synonyms | - |
Exact Mass | |
Formula | C31H59NO8 |
Category | Sphingolipids [SP] |
Main Class | Neutral glycosphingolipids [SP05] |
Sub Class | Simple Glc series [SP0501] |
PubChem Compound ID (CID) | - |
InChIKey | UHIIBQDSLAPQRJ-IIXJSGGGSA-N |
InChI | InChI=1S/C31H59NO8/c1-3-5-7-9-11-12-13-15-16-18-20-25(34)24(32-27(35)21-19-17-14 -10-8-6-4-2)23-39-31-30(38)29(37)28(36)26(22-33)40-31/h12-13,24-26,28-31,33-34,3 6-38H,3-11,14-23H2,1-2H3,(H,32,35)/b13-12+/t24-,25+,26+,28+,29?,30?,31+/m0/s1 |
SMILES | [C@](CO[C@@H]1O[C@H](CO)[C@@H](O)C(O)C1O)([H])(NC(CCCCCCCCC)=O)[C@]([H])(O)CCCC/ C=C/CCCCCC |
MS Spectra | - |
Status | Active (generated by computational methods) |