Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA008331
PROPERTIES
NPAID | NPA008331 |
---|---|
CLUSTER ID | 69 |
NODE ID | 64 |
NAME | Erinarol E |
FORMULA | C46H80O4 |
MOLECULAR WEIGHT (Da) | 697.1420 |
ACCURATE MASS (Da) | 696.6057 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Hericium |
ORIGIN SPECIES | erinaceum |
InChIKey | ACLTWGZKVIQUPD-XHAHBFBPSA-N |
InChI | InChI=1S/C46H80O4/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-43(48)50-37-28-31-45(7)41-29-30-44(6)39(36(5)25-24-35(4)34(2)3)26-27-40(44)38(41)32-42(47)46(45,49)33-37/h24-25,32,34-37,39-42,47,49H,8-23,26-31,33H2,1-7H3/b25-24+/t35-,36+,37-,39+,40-,41-,42-,44+,45+,46-/m0/s1 |
SMILES | CCCCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H](C3=C[C@@H]([C@]2(C1)O)O)CC[C@@H]4[C@H](C)/C=C/[C@H](C)C(C)C)C)C |
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. | ||
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DOI | 10.1021/np500234f | PMID | 25437304 |