Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA000012
PROPERTIES
NPAID | NPA000012 |
---|---|
CLUSTER ID | 12 |
NODE ID | 12 |
NAME | Spiroleptosphol B |
FORMULA | C19H28O5 |
MOLECULAR WEIGHT (Da) | 336.4280 |
ACCURATE MASS (Da) | 336.1937 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Leptosphaeria |
ORIGIN SPECIES | doliolum |
InChIKey | KMJIBJZHUZVXRL-GIDIXUSBSA-N |
InChI | InChI=1S/C19H28O5/c1-5-11(2)10-12(3)6-7-13-8-9-14(20)15-19(13)16(21)18(4,23-15)24-17(19)22/h6-9,11-16,20-21H,5,10H2,1-4H3/b7-6+/t11-,12+,13-,14-,15+,16?,18-,19-/m1/s1 |
SMILES | CC[C@@H](C)C[C@@H](C)/C=C/[C@@H]1C=C[C@H]([C@H]2[C@@]13C([C@](O2)(OC3=O)C)O)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Murakami, Takanori; Tsushima, Taro; Takada, Noboru; Tanaka, Kazuaki; Nihei, Ken-ichi; Miura, Tomisato; Hashimoto, Masaru Four analogues of spiroleptosphol isolated from Leptosphaeria doliolum Bioorganic and Medicinal Chemistry 2009 17 (2) 492-495. | ||
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DOI | 10.1016/j.bmc.2008.12.004 | PMID | 19109021 |