Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA011426
PROPERTIES
| NPAID | NPA011426 |
|---|---|
| CLUSTER ID | 4415 |
| NODE ID | 3243 |
| NAME | Hirtusneanoside |
| FORMULA | C40H46O17 |
| MOLECULAR WEIGHT (Da) | 798.7910 |
| ACCURATE MASS (Da) | 798.2735 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Usnea |
| ORIGIN SPECIES | hirta |
| InChIKey | FNZBYDYWSZYKKA-LCPKQBKDSA-N |
| InChI | InChI=1S/C40H46O17/c1-12-8-18-29(56-35-20(41)10-14(3)31(48)39(35,33(18)50)11-54-37-28(47)27(46)24(43)17(6)55-37)25(44)21(12)22-13(2)9-19-30(26(22)45)57-36-23(42)15(4)16(5)32(49)40(36,34(19)51)38(52)53-7/h8-9,14-17,24,27-28,31-32,37,41-49H,10-11H2,1-7H3/t14-,15-,16-,17?,24?,27?,28?,31-,32+,37?,39+,40+/m1/s1 |
| SMILES | C[C@@H]1CC(=C2[C@@]([C@@H]1O)(C(=O)C3=CC(=C(C(=C3O2)O)C4=C(C=C5C(=C4O)OC6=C([C@@H]([C@H]([C@@H]([C@@]6(C5=O)C(=O)OC)O)C)C)O)C)C)COC7C(C(C(C(O7)C)O)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Rezanka, Tomas; Sigler, Karel Hirtusneanoside, an unsymmetrical dimeric tetrahydroxanthone from the lichen Usnea hirta Journal of Natural Products 2007 70 (9) 1487-1491. | ||
|---|---|---|---|
| DOI | 10.1021/np070079m | PMID | 17822296 |
