Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA009603
PROPERTIES
NPAID | NPA009603 |
---|---|
CLUSTER ID | 863 |
NODE ID | 747 |
NAME | Melleolide N |
FORMULA | C23H29ClO6 |
MOLECULAR WEIGHT (Da) | 436.9320 |
ACCURATE MASS (Da) | 436.1653 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Armillaria |
ORIGIN SPECIES | mellea |
InChIKey | LRJNLSGTPANDCI-PPUVGZBRSA-N |
InChI | InChI=1S/C23H29ClO6/c1-11-18(15(25)6-16(26)19(11)24)20(28)30-10-13-5-12-7-21(2,3)8-14(12)22(4)9-17(27)23(13,22)29/h5-6,12,14,17,25-27,29H,7-10H2,1-4H3/t12-,14+,17-,22-,23+/m1/s1 |
SMILES | CC1=C(C(=CC(=C1Cl)O)O)C(=O)OCC2=C[C@@H]3CC(C[C@@H]3[C@@]4([C@]2([C@@H](C4)O)O)C)(C)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Chen, Chien-Chih; Kuo, Yueh-Hsiung; Cheng, Jing-Jy; Sung, Ping-Jyun; Ni, Ching-Li; Chen, Chin-Chu; Shen, Chien-Chang Three new sesquiterpene aryl esters from the mycelium of armillaria mellea Molecules 2015 20 (6) 9994-10003. | ||
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DOI | 10.3390/molecules20069994 | PMID | 26035099 |