Compounds
COMPOUND NPA030141
PROPERTIES
| NPAID | NPA030141 |
|---|---|
| CLUSTER ID | 8870 |
| NODE ID | 3122 |
| NAME | Dehydroabietic acid |
| FORMULA | C20H28O2 |
| MOLECULAR WEIGHT (Da) | 300.4420 |
| ACCURATE MASS (Da) | 300.2089 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Nostoc |
| ORIGIN SPECIES | sp. |
| InChIKey | NFWKVWVWBFBAOV-MISYRCLQSA-N |
| InChI | InChI=1S/C20H28O2/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22/h6,8,12-13,17H,5,7,9-11H2,1-4H3,(H,21,22)/t17-,19-,20-/m1/s1 |
| SMILES | CC(C)C1=CC2=C(C=C1)[C@@]1(C)CCC[C@@](C)(C(=O)O)[C@@H]1CC2 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Costa, MS; Rego, A; Ramos, V; Afonso, TB; Freitas, S; Preto, M; Lopes, V; Vasconcelos, V; Magalhães, C; Leão, PN The conifer biomarkers dehydroabietic and abietic acids are widespread in Cyanobacteria. Scientific Reports 2016 6 23436. | ||
|---|---|---|---|
| DOI | 10.1038/srep23436 | PMID | 26996104 |
