Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA016553
PROPERTIES
| NPAID | NPA016553 |
|---|---|
| CLUSTER ID | 5595 |
| NODE ID | 3961 |
| NAME | Botrytisic acid A |
| FORMULA | C15H20O3 |
| MOLECULAR WEIGHT (Da) | 248.3220 |
| ACCURATE MASS (Da) | 248.1412 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Botrytis |
| ORIGIN SPECIES | cinerea TB-3-H8 |
| InChIKey | YMEFRSQFXGVNCO-RQDFUGDESA-N |
| InChI | InChI=1S/C15H20O3/c1-11(10-12(16)17)6-9-15(4)8-5-7-14(2,3)13(15)18/h5-6,8-10H,7H2,1-4H3,(H,16,17)/b9-6+,11-10- |
| SMILES | C/C(=C/C(=O)O)/C=C/C1(C=CCC(C1=O)(C)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Wang, Tian-Shan; Zhou, Jin-Yan; Tan, Hong Three new metabolites from Botrytis cinerea Journal of Asian Natural Products Research 2008 10 (10) 919-924. | ||
|---|---|---|---|
| DOI | 10.1080/10286020802016065 | PMID | 19003608 |
