Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA017244
PROPERTIES
NPAID | NPA017244 |
---|---|
CLUSTER ID | 1512 |
NODE ID | 1245 |
NAME | Comnostin B |
FORMULA | C27H38O4 |
MOLECULAR WEIGHT (Da) | 426.5970 |
ACCURATE MASS (Da) | 426.2770 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Nostoc |
ORIGIN SPECIES | commune |
InChIKey | JBBYKAGPJLHVPI-YIZMITPNSA-N |
InChI | InChI=1S/C27H38O4/c1-17-8-12-25(3)21(10-13-27(5)22(25)9-11-24(27,2)16-28)26(17,4)15-19-14-18(23(30)31)6-7-20(19)29/h6-7,14,16-17,21-22,29H,8-13,15H2,1-5H3,(H,30,31)/t17-,21?,22?,24+,25+,26-,27-/m1/s1 |
SMILES | C[C@@H]1CC[C@@]2(C3CC[C@@]([C@@]3(CCC2[C@]1(C)CC4=C(C=CC(=C4)C(=O)O)O)C)(C)C=O)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Jaki; Orjala; Heilmann; Linden; Vogler; Sticher Novel extracellular diterpenoids with biological activity from the cyanobacterium Nostoc commune Journal of Natural Products 2000 63 (3) 339-343. | ||
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DOI | 10.1021/np9903090 | PMID | 10757714 |