Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA003788
PROPERTIES
| NPAID | NPA003788 |
|---|---|
| CLUSTER ID | 2050 |
| NODE ID | 1642 |
| NAME | (4S,5S)-4,5-dihydroxy-2-methylcyclohex-2-enone |
| FORMULA | C7H10O3 |
| MOLECULAR WEIGHT (Da) | 142.1540 |
| ACCURATE MASS (Da) | 142.0630 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Lasiodiplodia |
| ORIGIN SPECIES | theobromae OCS71 |
| InChIKey | LOFGUEYYNOZLJL-BQBZGAKWSA-N |
| InChI | InChI=1S/C7H10O3/c1-4-2-6(9)7(10)3-5(4)8/h2,6-7,9-10H,3H2,1H3/t6-,7-/m0/s1 |
| SMILES | CC1=C[C@@H]([C@H](CC1=O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | TAKEI, Ryo; TAKAHASHI, Kosaku; MATSUURA, Hideyuki; NABETA, Kensuke New Potato Micro-Tuber-Inducing Cyclohexene Compounds Related to Theobroxide from Lasiodiplodia theobromae Bioscience Biotechnology and Biochemistry 2008 72 (8) 2069-2073. | ||
|---|---|---|---|
| DOI | 10.1271/bbb.80171 | PMID | 18685216 |
