Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA007167
PROPERTIES
NPAID | NPA007167 |
---|---|
CLUSTER ID | 106 |
NODE ID | 101 |
NAME | Cohaerin D |
FORMULA | C28H32O7 |
MOLECULAR WEIGHT (Da) | 480.5570 |
ACCURATE MASS (Da) | 480.2148 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Annulohypoxylon |
ORIGIN SPECIES | cohaerens |
InChIKey | LFNOEQKIIMCRRH-JNTJAGMPSA-N |
InChI | InChI=1S/C28H32O7/c1-5-6-7-8-9-15(2)26(32)24-25-19-14-34-21(23-16(3)10-18(29)13-20(23)30)11-17(19)12-22(31)28(25,4)35-27(24)33/h11-12,14-15,18,29H,5-10,13H2,1-4H3/t15?,18?,28-/m0/s1 |
SMILES | CCCCCCC(C)C(=O)C1=C2C3=COC(=CC3=CC(=O)[C@@]2(OC1=O)C)C4=C(CC(CC4=O)O)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Quang, Dang Ngoc; Stadler, Marc; Fournier, Jacques; Tomita, Ayumi; Hashimoto, Toshihiro Cohaerins C-F, four azaphilones from the xylariaceous fungus Annulohypoxylon cohaerens Tetrahedron 2006 62 (26) 6349-6354. | ||
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DOI | 10.1016/j.tet.2006.04.040 | PMID | - |