Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA021977
PROPERTIES
| NPAID | NPA021977 |
|---|---|
| CLUSTER ID | 6797 |
| NODE ID | 4702 |
| NAME | Hypocriol F |
| FORMULA | C32H48O6 |
| MOLECULAR WEIGHT (Da) | 528.7300 |
| ACCURATE MASS (Da) | 528.3451 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Hypocrea |
| ORIGIN SPECIES | sp. |
| InChIKey | JGYIONACGHATIB-SXLCYRRSSA-N |
| InChI | InChI=1S/C32H48O6/c1-18-10-11-22-25(30(8,16-33)14-28(22,4)5)21(18)13-36-27-24-19(2)12-23(38-20(3)34)26-29(6,7)15-31(9,17-37-27)32(24,26)35/h10-11,19,23-24,26-27,33,35H,12-17H2,1-9H3/t19-,23+,24-,26+,27+,30-,31-,32-/m1/s1 |
| SMILES | C[C@@H]1C[C@@H]([C@@H]2[C@@]3([C@H]1[C@H](OC[C@]3(CC2(C)C)C)OCC4=C(C=CC5=C4[C@@](CC5(C)C)(C)CO)C)O)OC(=O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Ren, Fengxia; Zhu, Shuaiming; Wang, Bo; Li, Li; Liu, Xingzhong; Su, Ruibin; Che, Yongsheng Hypocriols A-F, Heterodimeric Botryane Ethers from Hypocrea sp., an Insect-Associated Fungus Journal of Natural Products 2016 79 (7) 1848-1856. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.6b00394 | PMID | 27328173 |
