Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA026046
PROPERTIES
| NPAID | NPA026046 |
|---|---|
| CLUSTER ID | 2076 |
| NODE ID | 1661 |
| NAME | (7S,11R)-12-acetoxy-sydowic acid |
| FORMULA | C17H22O6 |
| MOLECULAR WEIGHT (Da) | 322.3570 |
| ACCURATE MASS (Da) | 322.1416 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | versicolor |
| InChIKey | QFLRLCSGTIQEIB-SJORKVTESA-N |
| InChI | InChI=1S/C17H22O6/c1-11(18)22-10-16(2)7-4-8-17(3,23-16)13-6-5-12(15(20)21)9-14(13)19/h5-6,9,19H,4,7-8,10H2,1-3H3,(H,20,21)/t16-,17+/m1/s1 |
| SMILES | CC(=O)OC[C@@]1(C)CCC[C@@](C)(C2=C(O)C=C(C(=O)O)C=C2)O1 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Elsbaey, Marwa; Tanaka, Chiaki; Miyamoto, Tomofumi New secondary metabolites from the mangrove endophytic fungus Aspergillus versicolor Phytochemistry Letters 2019 32 70-76. | ||
|---|---|---|---|
| DOI | 10.1016/j.phytol.2019.04.023 | PMID | - |
