Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA006811
PROPERTIES
NPAID | NPA006811 |
---|---|
CLUSTER ID | 69 |
NODE ID | 64 |
NAME | Erinarol C |
FORMULA | C46H74O4 |
MOLECULAR WEIGHT (Da) | 691.0940 |
ACCURATE MASS (Da) | 690.5587 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Hericium |
ORIGIN SPECIES | erinaceum |
InChIKey | XZUZJKFYUFSQNX-DMKUNACRSA-N |
InChI | InChI=1S/C46H74O4/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-43(48)50-42-32-38-40-27-26-39(36(5)25-24-35(4)34(2)3)44(40,6)30-29-41(38)45(7)31-28-37(47)33-46(42,45)49/h9-10,12-13,15-16,24-25,32,34-37,39-42,47,49H,8,11,14,17-23,26-31,33H2,1-7H3/b10-9-,13-12-,16-15-,25-24+/t35-,36+,37-,39+,40-,41-,42+,44+,45+,46-/m0/s1 |
SMILES | CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O[C@@H]1C=C2[C@@H]3CC[C@@H]([C@]3(CC[C@@H]2[C@@]4([C@@]1(C[C@H](CC4)O)O)C)C)[C@H](C)/C=C/[C@H](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 |