Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA016192
PROPERTIES
| NPAID | NPA016192 |
|---|---|
| CLUSTER ID | 5096 |
| NODE ID | 3650 |
| NAME | (1S)-7-[(2E)-but-2-enoyl]-1,3,3,6-tetramethyl-2,3-dihydro-1H-indene-1-carbaldehyde |
| FORMULA | C18H22O2 |
| MOLECULAR WEIGHT (Da) | 270.3720 |
| ACCURATE MASS (Da) | 270.1620 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Hypoxylon |
| ORIGIN SPECIES | rickii |
| InChIKey | YCLWCRCXZPDERE-IPLHWJFFSA-N |
| InChI | InChI=1S/C18H22O2/c1-6-7-14(20)15-12(2)8-9-13-16(15)18(5,11-19)10-17(13,3)4/h6-9,11H,10H2,1-5H3/b7-6+/t18-/m1/s1 |
| SMILES | C/C=C/C(=O)C1=C(C=CC2=C1[C@@](CC2(C)C)(C)C=O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Kuhnert, Eric; Surup, Frank; Wiebach, Vincent; Bernecker, Steffen; Stadler, Marc Botryane, noreudesmane and abietane terpenoids from the ascomycete Hypoxylon rickii Phytochemistry 2015 117 116-122. | ||
|---|---|---|---|
| DOI | 10.1016/j.phytochem.2015.06.002 | PMID | 26071840 |
