Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA025781
PROPERTIES
| NPAID | NPA025781 |
|---|---|
| CLUSTER ID | 1372 |
| NODE ID | 1154 |
| NAME | Asperterpenoid C |
| FORMULA | C25H38O4 |
| MOLECULAR WEIGHT (Da) | 402.5750 |
| ACCURATE MASS (Da) | 402.2770 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | oryzae |
| InChIKey | HOJAIZSMUNKBJQ-SXFKLJQYSA-N |
| InChI | InChI=1S/C25H38O4/c1-13(2)15-9-19(27)23(3)7-8-25(12-26)10-16-14(22(28)29)5-6-17(16)24(4)11-18(24)21(25)20(15)23/h13,15,17-21,26-27H,5-12H2,1-4H3,(H,28,29)/t15-,17-,18-,19-,20+,21+,23-,24+,25-/m1/s1 |
| SMILES | CC(C)[C@H]1C[C@@H](O)[C@@]2(C)CC[C@]3(CO)CC4=C(C(=O)O)CC[C@H]4[C@]4(C)C[C@@H]4[C@H]3[C@H]12 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Huang, Jia-Hua; Lv, Jian-Ming; Wang, Qiao-Zhen; Zou, Jian; Lu, Yong-Jun; Wang, Qing-Lin; Chen, Dong-Ni; Yao, Xin-Sheng; Gao, Hao; Hu, Dan Biosynthesis of an anti-tuberculosis sesterterpenoid asperterpenoid A Organic & Biomolecular Chemistry 2019 17 (2) 248-251. | ||
|---|---|---|---|
| DOI | 10.1039/c8ob02832j | PMID | 30548032 |
