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Compounds

COMPOUND NPA021975

STRUCTURE
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PROPERTIES
NPAID NPA021975
CLUSTER ID 6796
NODE ID 4701
NAME Hypocriol D
FORMULA C33H48O7
MOLECULAR WEIGHT (Da) 556.7400
ACCURATE MASS (Da) 556.3400
ORIGIN ORGANISM TYPE Fungus
ORIGIN GENUS Hypocrea
ORIGIN SPECIES sp.
InChIKey PBKZIJVPGCDCOR-CTTWNACISA-N
InChI InChI=1S/C33H48O7/c1-16-11-12-19-23-21(16)27(37-10)40-28(31(23,8)14-29(19,4)5)39-26-24(35)22-17(2)13-20(38-18(3)34)25-30(6,7)15-32(26,9)33(22,25)36/h11-12,17,20,22,24-28,35-36H,13-15H2,1-10H3/t17-,20+,22-,24-,25+,26+,27+,28-,31+,32-,33-/m1/s1
SMILES C[C@@H]1C[C@@H]([C@@H]2[C@@]3([C@H]1[C@H]([C@@H]([C@]3(CC2(C)C)C)O[C@H]4[C@]5(CC(C6=C5C(=C(C=C6)C)[C@H](O4)OC)(C)C)C)O)O)OC(=O)C
ORIGINAL ISOLATION REFERENCE
CITATION Ren, Fengxia; Zhu, Shuaiming; Wang, Bo; Li, Li; Liu, Xingzhong; Su, Ruibin; Che, Yongsheng Hypocriols A-F, Heterodimeric Botryane Ethers from Hypocrea sp., an Insect-Associated Fungus Journal of Natural Products 2016 79 (7) 1848-1856.
DOI 10.1021/acs.jnatprod.6b00394 PMID 27328173
ORIGINAL ISOLATION TAXONOMY
RANK NAME DB LINK NCBI
Domain Eukarya - 2759
Kingdom Fungi MycoBank 4751
Phylum Ascomycota MycoBank 4890
Class Sordariomycetes MycoBank 147550
Order Hypocreales MycoBank 5125
Family Hypocreaceae MycoBank 5129
Genus Hypocrea MycoBank -
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