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Compounds

COMPOUND NPA026795

STRUCTURE
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PROPERTIES
NPAID NPA026795
CLUSTER ID 8110
NODE ID 5505
NAME Emerione A
FORMULA C29H44O5
MOLECULAR WEIGHT (Da) 472.6660
ACCURATE MASS (Da) 472.3189
ORIGIN ORGANISM TYPE Fungus
ORIGIN GENUS Emericella
ORIGIN SPECIES nidulans
InChIKey RNAHYXBPBZSDMH-CABZIAIVSA-N
InChI InChI=1S/C29H44O5/c1-14(2)19(30)17(5)21(31)27(9)20(25(7)12-16(4)22-29(11,33-22)23(25)27)15(3)13-26(8)24-28(10,34-24)18(6)32-26/h12-14,17-18,20-24,31H,1-11H3/b15-13+/t17-,18+,20+,21-,22+,23-,24-,25-,26-,27+,28+,29+/m0/s1
SMILES CC1=C[C@@]2(C)[C@@H](/C(C)=C/[C@]3(C)O[C@H](C)[C@@]4(C)O[C@@H]34)[C@](C)([C@@H](O)[C@@H](C)C(=O)C(C)C)[C@H]2[C@]2(C)O[C@H]12
ORIGINAL ISOLATION REFERENCE
CITATION Li, Qin; Chen, Chunmei; He, Yan; Guan, Danyingzi; Cheng, Li; Hao, Xincai; Wei, Mengsha; Zheng, Yinyu; Liu, Chang; Li, Xiao-Nian; Zhou, Qun; Zhu, Hucheng; Zhang, Yonghui Emeriones A-C: Three Highly Methylated Polyketides with Bicyclo[4.2.0]octene and 3,6-Dioxabicyclo[3.1.0]hexane Functionalities from Emericella nidulans Organic Letters 2019 21 (13) 5091-5095.
DOI 10.1021/acs.orglett.9b01680 PMID 31247789
ORIGINAL ISOLATION TAXONOMY
RANK NAME DB LINK NCBI
Domain Eukarya - 2759
Kingdom Fungi MycoBank 4751
Phylum Ascomycota MycoBank 4890
Class Eurotiomycetes MycoBank 147545
Order Eurotiales MycoBank 5042
Family Trichocomaceae MycoBank 28568
Genus Emericella MycoBank 5071
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