Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA008403
PROPERTIES
NPAID | NPA008403 |
---|---|
CLUSTER ID | 3205 |
NODE ID | 2438 |
NAME | Cytochalasin Z11 |
FORMULA | C25H33NO5 |
MOLECULAR WEIGHT (Da) | 427.5410 |
ACCURATE MASS (Da) | 427.2359 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Spicaria |
ORIGIN SPECIES | elegans |
InChIKey | XKLGDBFKKUIZTH-UPQYTXQESA-N |
InChI | InChI=1S/C25H33NO5/c1-14(22(28)17(4)27)9-8-12-19-23(29)16(3)15(2)21-20(26-24(30)25(19,21)31)13-18-10-6-5-7-11-18/h5-8,10-12,14-15,17,19-21,23,27,29,31H,3,9,13H2,1-2,4H3,(H,26,30)/b12-8+/t14-,15+,17-,19-,20-,21-,23+,25+/m0/s1 |
SMILES | C[C@H]1[C@H]2[C@@H](NC(=O)[C@]2([C@H]([C@@H](C1=C)O)/C=C/C[C@H](C)C(=O)[C@H](C)O)O)CC3=CC=CC=C3 |
ORIGINAL ISOLATION REFERENCE
CITATION | Liu, Rui; Lin, Zhenjian; Zhu, Tianjiao; Fang, Yuchun; Gu, Qianqun; Zhu, Weiming Novel Open-Chain Cytochalsins from the Marine-Derived Fungus Spicaria elegans Journal of Natural Products 2008 71 (7) 1127-1132. | ||
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DOI | 10.1021/np070539b | PMID | 18507474 |