Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA011407
PROPERTIES
| NPAID | NPA011407 |
|---|---|
| CLUSTER ID | 325 |
| NODE ID | 295 |
| NAME | Kolokoside D |
| FORMULA | C36H58O10 |
| MOLECULAR WEIGHT (Da) | 650.8500 |
| ACCURATE MASS (Da) | 650.4030 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Xylaria |
| ORIGIN SPECIES | sp. |
| InChIKey | RSMJJPJAEKNFLV-LTKLRBQVSA-N |
| InChI | InChI=1S/C36H58O10/c1-17(2)20-16-44-30(43)28-34(6)12-11-18-19(35(34,7)14-24(39)36(20,28)8)9-10-23-32(3,4)29(21(38)13-33(18,23)5)46-31-27(42)26(41)25(40)22(15-37)45-31/h11,17,19-29,31,37-42H,9-10,12-16H2,1-8H3/t19-,20+,21+,22+,23-,24+,25+,26-,27+,28-,29-,31-,33+,34-,35+,36-/m0/s1 |
| SMILES | CC(C)[C@H]1COC(=O)[C@@H]2[C@@]1([C@@H](C[C@]3([C@]2(CC=C4[C@@H]3CC[C@@H]5[C@@]4(C[C@H]([C@@H](C5(C)C)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O)C)C)C)O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Deyrup, Stephen T.; Gloer, James B.; O'Donnell, Kerry; Wicklow, Donald T. Kolokosides A-D: Triterpenoid glycosides from a Hawaiian isolate of Xylaria sp Journal of Natural Products 2007 70 (3) 378-382. | ||
|---|---|---|---|
| DOI | 10.1021/np060546k | PMID | 17284074 |
