Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA003977
PROPERTIES
NPAID | NPA003977 |
---|---|
CLUSTER ID | 69 |
NODE ID | 64 |
NAME | Erinarol A |
FORMULA | C46H76O4 |
MOLECULAR WEIGHT (Da) | 693.1100 |
ACCURATE MASS (Da) | 692.5744 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Hericium |
ORIGIN SPECIES | erinaceum |
InChIKey | RUMWTSNHGVWHSU-HVXPJFCMSA-N |
InChI | InChI=1S/C46H76O4/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-40(48)49-42-41-38-27-26-37(35(5)25-24-34(4)33(2)3)44(38,6)30-29-39(41)45(7)31-28-36(47)32-46(45)43(42)50-46/h15-16,24-25,33-37,39,42-43,47H,8-14,17-23,26-32H2,1-7H3/b16-15-,25-24+/t34-,35+,36-,37+,39-,42-,43-,44+,45+,46-/m0/s1 |
SMILES | CCCCCCCC/C=C\CCCCCCCC(=O)O[C@@H]1[C@H]2[C@@]3(O2)C[C@H](CC[C@@]3([C@@H]4C1=C5CC[C@@H]([C@]5(CC4)C)[C@H](C)/C=C/[C@H](C)C(C)C)C)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Li, Wei; Zhou, Wei; Song, Seok Bean; Shim, Sang Hee; Kim, Young Ho Sterol fatty acid esters from the mushroom Hericium erinaceum and their PPAR transactivational effects Journal of Natural Products 2014 77 (12) 2611-2618. | ||
---|---|---|---|
DOI | 10.1021/np500234f | PMID | 25437304 |