Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA012881
PROPERTIES
NPAID | NPA012881 |
---|---|
CLUSTER ID | 1191 |
NODE ID | 1013 |
NAME | Cryptosporioptide |
FORMULA | C38H34O18 |
MOLECULAR WEIGHT (Da) | 778.6720 |
ACCURATE MASS (Da) | 778.1745 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Cryptosporiopsis |
ORIGIN SPECIES | sp. |
InChIKey | PWQAHOPTVKKMLO-ITMJCMDYSA-N |
InChI | InChI=1S/C38H34O18/c1-35-23(29(47)31-37(3,55-31)33(35)51-19(41)11-17(39)49-5)27(45)21-15(53-35)9-7-13(25(21)43)14-8-10-16-22(26(14)44)28(46)24-30(48)32-38(4,56-32)34(36(24,2)54-16)52-20(42)12-18(40)50-6/h7-10,31-34,43-46H,11-12H2,1-6H3/t31-,32-,33+,34+,35+,36+,37-,38-/m0/s1 |
SMILES | C[C@@]12[C@@H](O1)C(=O)C3=C(C4=C(C=CC(=C4O)C5=C(C6=C(C=C5)O[C@]7([C@H]([C@@]8([C@@H](O8)C(=O)C7=C6O)C)OC(=O)CC(=O)OC)C)O)O[C@]3([C@H]2OC(=O)CC(=O)OC)C)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Saleem, Muhammad; Tousif, Muhammad Imran; Riaz, Naheed; Ahmed, Ishtiaq; Schulz, Barbara; Ashraf, Muhammad; Nasar, Rumana; Pescitelli, Gennaro; Hussain, Hidayat; Jabbar, Abdul; Shafiq, Nusrat; Krohn, Karsten Cryptosporioptide: A bioactive polyketide produced by an endophytic fungus Cryptosporiopsis sp Phytochemistry 2013 93 199-202. | ||
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DOI | 10.1016/j.phytochem.2013.03.018 | PMID | 23642454 |