Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA008099
PROPERTIES
NPAID | NPA008099 |
---|---|
CLUSTER ID | 2164 |
NODE ID | 163 |
NAME | Gymnasterone D |
FORMULA | C28H38O2 |
MOLECULAR WEIGHT (Da) | 406.6100 |
ACCURATE MASS (Da) | 406.2872 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Gymnascella |
ORIGIN SPECIES | dankaliensis |
InChIKey | GQXHQDCLIABAJK-FYQXRWMHSA-N |
InChI | InChI=1S/C28H38O2/c1-17(2)18(3)7-8-19(4)24-16-25(30)26-22-10-9-20-15-21(29)11-13-27(20,5)23(22)12-14-28(24,26)6/h7-10,15,17-19,23-24H,11-14,16H2,1-6H3/b8-7+/t18-,19+,23-,24+,27-,28+/m0/s1 |
SMILES | C[C@H](/C=C/[C@H](C)C(C)C)[C@H]1CC(=O)C2=C3C=CC4=CC(=O)CC[C@@]4([C@H]3CC[C@]12C)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Amagata, Taro; Tanaka, Makoto; Yamada, Takeshi; Doi, Mitsunobu; Minoura, Katsuhiko; Ohishi, Hirofumi; Yamori, Takao; Numata, Atsushi Variation in cytostatic constituents of a sponge-derived Gymnascella dankaliensis by manipulating the carbon source Journal of Natural Products 2007 70 (11) 1731-1740. | ||
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DOI | 10.1021/np070165m | PMID | 17988094 |