Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA013085
PROPERTIES
| NPAID | NPA013085 |
|---|---|
| CLUSTER ID | 46 |
| NODE ID | 11 |
| NAME | Aphthosin |
| FORMULA | C34H30O13 |
| MOLECULAR WEIGHT (Da) | 646.6010 |
| ACCURATE MASS (Da) | 646.1686 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Peltigera |
| ORIGIN SPECIES | aphthosa Willd |
| InChIKey | VIOAANSIBLJPLO-UHFFFAOYSA-N |
| InChI | InChI=1S/C34H30O13/c1-15-7-19(43-5)11-23(35)28(15)32(40)46-21-9-17(3)30(25(37)13-21)34(42)47-22-10-18(4)29(26(38)14-22)33(41)45-20-8-16(2)27(24(36)12-20)31(39)44-6/h7-14,35-38H,1-6H3 |
| SMILES | CC1=CC(=CC(=C1C(=O)OC2=CC(=C(C(=C2)C)C(=O)OC3=CC(=C(C(=C3)C)C(=O)OC4=CC(=C(C(=C4)C)C(=O)OC)O)O)O)O)OC |
ORIGINAL ISOLATION REFERENCE
| CITATION | Bachelor, F.W.; King, G.G. Chemical constituents of lichens: aphthosin, a homologue of peltigerin Phytochemistry 1970 9 (12) 2587-2589. | ||
|---|---|---|---|
| DOI | 10.1016/s0031-9422(00)85785-4 | PMID | - |
