Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA010564
PROPERTIES
NPAID | NPA010564 |
---|---|
CLUSTER ID | 4123 |
NODE ID | 3062 |
NAME | Chaxine C |
FORMULA | C28H40O4 |
MOLECULAR WEIGHT (Da) | 440.6240 |
ACCURATE MASS (Da) | 440.2927 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Agrocybe |
ORIGIN SPECIES | chaxingu |
InChIKey | HHOHGMGBNVADCJ-JHGRJPAVSA-N |
InChI | InChI=1S/C28H40O4/c1-18(2)19(3)10-11-20(4)22-12-13-23-21(24(29)14-16-27(22,23)5)17-26(31)32-28(6)15-8-7-9-25(28)30/h7,9-11,17-20,22-23H,8,12-16H2,1-6H3/b11-10+,21-17-/t19?,20?,22-,23+,27-,28?/m1/s1 |
SMILES | CC(C)C(C)/C=C/C(C)[C@H]1CC[C@@H]\2[C@@]1(CCC(=O)/C2=C\C(=O)OC3(CCC=CC3=O)C)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Choi, Jae-Hoon; Ogawa, Akihiro; Abe, Nobuo; Masuda, Kikuko; Koyama, Tomoyuki; Yazawa, Kazunaga; Kawagishi, Hirokazu Chaxines B, C, D, and E from the edible mushroom Agrocybe chaxingu Tetrahedron 2009 65 (47) 9850-9853. | ||
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DOI | 10.1016/j.tet.2009.09.064 | PMID | - |