Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA000078
PROPERTIES
NPAID | NPA000078 |
---|---|
CLUSTER ID | 68 |
NODE ID | 63 |
NAME | Clavirolide A |
FORMULA | C20H28O4 |
MOLECULAR WEIGHT (Da) | 332.4400 |
ACCURATE MASS (Da) | 332.1988 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Clavularia |
ORIGIN SPECIES | viridis |
InChIKey | JVYXSCVDLGVIRM-NOYREHSQSA-N |
InChI | InChI=1S/C20H28O4/c1-12-5-7-19(4)8-6-16-14(3)18(22)24-17(20(16,19)23)11-13(2)10-15(21)9-12/h5,13,17,23H,6-11H2,1-4H3/b12-5+/t13-,17-,19-,20-/m1/s1 |
SMILES | C[C@H]1C[C@@H]2[C@@]3(C(=C(C(=O)O2)C)CC[C@]3(C/C=C(/CC(=O)C1)\C)C)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Su, Jingyu; Zhong, Yongli; Shi, Kailiang; Cheng, Qi; Snyder, John K; Hu, Shengzhi; Huang, Youqing Clavudiol A and clavirolide A, two marine dolabellane diterpenes from the soft coral Clavularia viridis Journal of Organic Chemistry 1991 56 (7) 2337-2344. | ||
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DOI | 10.1021/jo00007a019 | PMID | - |