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Compounds

COMPOUND NPA002182

STRUCTURE
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PROPERTIES
NPAID NPA002182
CLUSTER ID 1324
NODE ID 1116
NAME Erinacerin A
FORMULA C27H31NO4
MOLECULAR WEIGHT (Da) 433.5480
ACCURATE MASS (Da) 433.2253
ORIGIN ORGANISM TYPE Fungus
ORIGIN GENUS Hericium
ORIGIN SPECIES erinaceum (BULL.: FR.) PERS. (Hericiaceae)
InChIKey VSETXQQLPHMGQF-UHFFFAOYSA-N
InChI InChI=1S/C27H31NO4/c1-18(2)14-20(29)16-27(3)12-10-21-24(31-4)15-22-23(25(21)32-27)17-28(26(22)30)13-11-19-8-6-5-7-9-19/h5-9,14-15H,10-13,16-17H2,1-4H3
SMILES CC(=CC(=O)CC1(CCC2=C(C=C3C(=C2O1)CN(C3=O)CCC4=CC=CC=C4)OC)C)C
ORIGINAL ISOLATION REFERENCE
CITATION Yaoita, Yasunori; Danbara, Kuniko; Kikuchi, Masao Two new aromatic compounds from Hericium erinaceum (Bull.: Fr.) Pers Chemical and Pharmaceutical Bulletin 2005 53 (9) 1202-1203.
DOI 10.1248/cpb.53.1202 PMID 16141599
ORIGINAL ISOLATION TAXONOMY
RANK NAME DB LINK NCBI
Domain Eukarya - 2759
Kingdom Fungi MycoBank 4751
Phylum Basidiomycota MycoBank 5204
Class Agaricomycetes MycoBank 155619
Order Russulales MycoBank 452342
Family Hericiaceae MycoBank 40458
Genus Hericium MycoBank 40459
SYNTHESES
CITATION 1 Mun B; Kim S; Yoon H; Kim KH; Lee Y Total Synthesis of Isohericerin, Isohericenone, and Erinacerin A: Development of a Copper-Catalyzed Methylboronation of Terminal Alkynes. Journal of Organic Chemistry 2017 82 (12) 6349-6357. DOI: 10.1021/acs.joc.7b00920 PMID: 28557446
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