Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA025580
PROPERTIES
| NPAID | NPA025580 |
|---|---|
| CLUSTER ID | 7724 |
| NODE ID | 5268 |
| NAME | Irpexolidal |
| FORMULA | C31H42O6 |
| MOLECULAR WEIGHT (Da) | 510.6710 |
| ACCURATE MASS (Da) | 510.2981 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Irpex |
| ORIGIN SPECIES | lacteus |
| InChIKey | XDTLRFKISVHVBF-MDVZJRDJSA-N |
| InChI | InChI=1S/C31H42O6/c1-16-12-31(18(3)17(2)25(35)37-31)36-19-13-28(7)27(6,24(16)19)10-9-20-29(8)21(14-30(20,28)15-32)26(4,5)22(33)11-23(29)34/h9,14-16,19,22-24,33-34H,10-13H2,1-8H3/t16-,19+,22-,23-,24+,27-,28-,29-,30+,31-/m1/s1 |
| SMILES | CC1=C(C)[C@@]2(C[C@@H](C)[C@H]3[C@H](C[C@@]4(C)[C@]5(C=O)C=C6C(C)(C)[C@H](O)C[C@@H](O)[C@]6(C)C5=CC[C@]34C)O2)OC1=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Tang, Yang; Zhao, Zhen-Zhu; Hu, Kun; Feng, Tao; Li, Zheng-Hui; Chen, He-Ping; Liu, Ji-Kai Irpexolidal Represents a Class of Triterpenoid from the Fruiting Bodies of the Medicinal Fungus Irpex lacteus Journal of Organic Chemistry 2019 84 (4) 1845-1852. | ||
|---|---|---|---|
| DOI | 10.1021/acs.joc.8b02764 | PMID | 30673259 |
