Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA003118
PROPERTIES
| NPAID | NPA003118 |
|---|---|
| CLUSTER ID | 36 |
| NODE ID | 35 |
| NAME | Gymnopilin A-9 |
| FORMULA | C51H94O12 |
| MOLECULAR WEIGHT (Da) | 899.3010 |
| ACCURATE MASS (Da) | 898.6745 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Gymnopilus |
| ORIGIN SPECIES | spectabilis |
| InChIKey | JNPNBPGXYIYVEV-FFSGXVOLSA-N |
| InChI | InChI=1S/C51H94O12/c1-39(2)20-13-25-45(5,56)27-16-29-47(7,58)31-18-33-49(9,60)34-19-32-48(8,59)30-17-28-46(6,57)26-14-23-40(3)21-12-22-41(4)24-15-35-51(11,62)42(52)38-63-44(55)37-50(10,61)36-43(53)54/h20-21,24,42,52,56-62H,12-19,22-23,25-38H2,1-11H3,(H,53,54)/b40-21+,41-24+/t42-,45?,46?,47?,48?,49?,50?,51?/m1/s1 |
| SMILES | CC(=CCCC(C)(CCCC(C)(CCCC(C)(CCCC(C)(CCCC(C)(CCC/C(=C/CC/C(=C/CCC(C)([C@@H](COC(=O)CC(C)(CC(=O)O)O)O)O)/C)/C)O)O)O)O)O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Aoyagi, Fukiko; Maeno, Sawae; Okuno, Toshikatsu; Matsumoto, Haruki; Ikura, Mitsuhiko; Hikichi, Kunio; Matsumoto, Takeshi Gymnopilins, bitter principles of the big-laughter mushroom Gymnopilus spectabilis Tetrahedron Letters 1983 24 (19) 1991-1994. | ||
|---|---|---|---|
| DOI | 10.1016/s0040-4039(00)81824-9 | PMID | - |
