In-Silico Structure database (LMISSD)
| |
LM ID | LMSP05019ACL |
---|---|
Common Name | GlcCer(t14:0/10:0) |
Systematic Name | N-(decanoyl)-1-β-glucosyl-4R-hydroxytetradecasphinganine |
Synonyms | - |
Exact Mass | |
Formula | C30H59NO9 |
Category | Sphingolipids [SP] |
Main Class | Neutral glycosphingolipids [SP05] |
Sub Class | Simple Glc series [SP0501] |
PubChem Compound ID (CID) | - |
InChIKey | YZGANJZAGYUMDC-HXXVKUOJSA-N |
InChI | InChI=1S/C30H59NO9/c1-3-5-7-9-11-13-14-16-18-23(33)26(35)22(31-25(34)19-17-15-12 -10-8-6-4-2)21-39-30-29(38)28(37)27(36)24(20-32)40-30/h22-24,26-30,32-33,35-38H, 3-21H2,1-2H3,(H,31,34)/t22-,23+,24+,26-,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@@H ](CCCCCCCCCC)O |
MS Spectra | - |
Status | Active (generated by computational methods) |