Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA018136
PROPERTIES
| NPAID | NPA018136 |
|---|---|
| CLUSTER ID | 1386 |
| NODE ID | 1164 |
| NAME | Thraustochytroside B |
| FORMULA | C41H77NO8 |
| MOLECULAR WEIGHT (Da) | 712.0660 |
| ACCURATE MASS (Da) | 711.5649 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Thraustochytrium |
| ORIGIN SPECIES | globosum |
| InChIKey | KVTQIFLWPGJDGA-BIXWJTBBSA-N |
| InChI | InChI=1S/C41H77NO8/c1-4-6-8-10-12-13-14-15-16-17-19-21-26-30-37(45)42-34(32-49-41-40(48)39(47)38(46)36(31-43)50-41)35(44)29-25-22-24-28-33(3)27-23-20-18-11-9-7-5-2/h25,28-29,34-36,38-41,43-44,46-48H,4-24,26-27,30-32H2,1-3H3,(H,42,45)/b29-25+,33-28+/t34-,35+,36+,38+,39-,40+,41-/m0/s1 |
| SMILES | CCCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)/C=C/CC/C=C(\C)CCCCCCCCC |
ORIGINAL ISOLATION REFERENCE
| CITATION | Jenkins, Kelly M.; Jensen, Paul R.; Fenical, William Thraustochytrosides A-C: New glycosphingolipids from a unique marine protist, Thraustochytrium globosum Tetrahedron Letters 1999 40 (43) 7637-7640. | ||
|---|---|---|---|
| DOI | 10.1016/s0040-4039(99)01562-2 | PMID | - |
