Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA010566
PROPERTIES
NPAID | NPA010566 |
---|---|
CLUSTER ID | 183 |
NODE ID | 171 |
NAME | Pestalotiollide B |
FORMULA | C21H22O7 |
MOLECULAR WEIGHT (Da) | 386.4000 |
ACCURATE MASS (Da) | 386.1366 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Pestalotiopsis |
ORIGIN SPECIES | sp. |
InChIKey | HHLSDNCZICXJDV-ROUUACIJSA-N |
InChI | InChI=1S/C21H22O7/c1-10(2)17(23)18(24)13-5-6-15-16(20(13)26-4)21(25)27-9-12-7-11(3)8-14(22)19(12)28-15/h5-8,17-18,22-24H,1,9H2,2-4H3/t17-,18-/m0/s1 |
SMILES | CC1=CC(=C2C(=C1)COC(=O)C3=C(O2)C=CC(=C3OC)[C@@H]([C@H](C(=C)C)O)O)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Xu, Jing; Aly, Amal H.; Wray, Victor; Proksch, Peter Polyketide derivatives of endophytic fungus Pestalotiopsis sp. isolated from the Chinese mangrove plant Rhizophora mucronata Tetrahedron Letters 2011 52 (1) 21-25. | ||
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DOI | 10.1016/j.tetlet.2010.10.131 | PMID | - |