Compounds
ID | Spectrum Quality | Annotated Name |
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COMPOUND NPA002182
PROPERTIES
NPAID | NPA002182 |
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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. | ||
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DOI | 10.1248/cpb.53.1202 | PMID | 16141599 |
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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