In-Silico Structure database (LMISSD)
| |
LM ID | LMSP05019AJI |
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Common Name | GlcCer(d14:2(4E,6E)/10:0) |
Systematic Name | N-(decanoyl)-1-β-glucosyl-4E,6E-tetradecasphingadienine |
Synonyms | - |
Exact Mass | |
Formula | C30H55NO8 |
Category | Sphingolipids [SP] |
Main Class | Neutral glycosphingolipids [SP05] |
Sub Class | Simple Glc series [SP0501] |
PubChem Compound ID (CID) | - |
InChIKey | LBGSBPLDMSCSEZ-XSUMMSQUSA-N |
InChI | InChI=1S/C30H55NO8/c1-3-5-7-9-11-12-14-15-17-19-24(33)23(31-26(34)20-18-16-13-10 -8-6-4-2)22-38-30-29(37)28(36)27(35)25(21-32)39-30/h14-15,17,19,23-25,27-30,32-3 3,35-37H,3-13,16,18,20-22H2,1-2H3,(H,31,34)/b15-14+,19-17+/t23-,24+,25+,27+,28?, 29?,30+/m0/s1 |
SMILES | [C@](CO[C@@H]1O[C@H](CO)[C@@H](O)C(O)C1O)([H])(NC(CCCCCCCCC)=O)[C@]([H])(O)/C=C/ C=C/CCCCCCC |
MS Spectra | - |
Status | Active (generated by computational methods) |