Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA011764
PROPERTIES
| NPAID | NPA011764 |
|---|---|
| CLUSTER ID | 4505 |
| NODE ID | 3296 |
| NAME | Pestaloficiol U |
| FORMULA | C33H33ClO9 |
| MOLECULAR WEIGHT (Da) | 609.0710 |
| ACCURATE MASS (Da) | 608.1813 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Pestalotiopsis |
| ORIGIN SPECIES | fici |
| InChIKey | YZQIHIQIUVBGNF-UHFFFAOYSA-N |
| InChI | InChI=1S/C33H33ClO9/c1-15(2)8-9-17-11-18(35)12-19-21(14-33(4,5)43-31(17)19)24-16(3)10-22(36)26(28(24)37)29(38)25-20(32(40)42-7)13-23(41-6)27(34)30(25)39/h8,10-14,35-37,39H,9H2,1-7H3 |
| SMILES | CC1=CC(=C(C(=C1C2=CC(OC3=C(C=C(C=C23)O)CC=C(C)C)(C)C)O)C(=O)C4=C(C(=C(C=C4C(=O)OC)OC)Cl)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Wu, Guangwei; Zhou, Haichuan; Zhang, Peng; Wang, Xiuna; Li, Wei; Zhang, Weiwei; Liu, Xingzhong; Liu, Hong-Wei; Keller, Nancy P.; An, Zhiqiang; Yin, Wen-Bing Polyketide Production of Pestaloficiols and Macrodiolide Ficiolides Revealed by Manipulations of Epigenetic Regulators in an Endophytic Fungus Organic Letters 2016 18 (8) 1832-1835. | ||
|---|---|---|---|
| DOI | 10.1021/acs.orglett.6b00562 | PMID | 27015125 |
