Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA006679
PROPERTIES
| NPAID | NPA006679 |
|---|---|
| CLUSTER ID | 3068 |
| NODE ID | 538 |
| NAME | Hawaiinolide B |
| FORMULA | C20H26O4 |
| MOLECULAR WEIGHT (Da) | 330.4240 |
| ACCURATE MASS (Da) | 330.1831 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Paraconiothyrium |
| ORIGIN SPECIES | hawaiiense |
| InChIKey | AFEUGPSCVTYZGI-WQNWOALFSA-N |
| InChI | InChI=1S/C20H26O4/c1-5-12-6-7-14-13(11(12)2)10-15(21)20(23)18(14,3)9-8-16-19(20,4)17(22)24-16/h5-6,11,13-14,16,23H,1,7-10H2,2-4H3/t11-,13-,14-,16-,18+,19+,20-/m0/s1 |
| SMILES | C[C@@H]1[C@@H]2CC(=O)[C@@]3([C@@]([C@H]2CC=C1C=C)(CC[C@H]4[C@@]3(C(=O)O4)C)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Chen, Shenxi; Zhang, Yang; Niu, Shubin; Liu, Xingzhong; Che, Yongsheng Cytotoxic cleistanthane and cassane diterpenoids from the entomogenous fungus Paraconiothyrium hawaiiense Journal of Natural Products 2014 77 (6) 1513-1518. | ||
|---|---|---|---|
| DOI | 10.1021/np500302e | PMID | 24882446 |
