KNApSAcK Metabolite C00047055
Metabolite
KNApSAcK Entry
| id | C00047055 |
|---|---|
| Name | Isospongiaquinone / (+)-Isospongiaquinone |
| CAS RN | 69672-66-8 |
| Standard InChI | InChI=1S/C22H30O4/c1-13-7-6-8-18-21(13,3)10-9-14(2)22(18,4)12-15-19(24)16(23)11-17(26-5)20(15)25/h7,11,14,18,24H,6,8-10,12H2,1-5H3/t14-,18+,21+,22+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C22H30O4/c1-13-7-6-8-18-21(13,3)10-9-14(2)22(18,4)12-15-19(24)16(23)11-17(26-5)20(15)25/h7,11,14,18,24H,6,8-10,12H2,1-5H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 477 |
Link
ChEMBL
| By standard InChI | CHEMBL496254 |
|---|---|
| By standard InChI Main Layer | CHEMBL496254 CHEMBL478586 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN | C079191 |
|---|
Species
Summary
Plant class
| class name | count |
|---|
Family
| family name | count |
|---|
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Hyrtios sp. |