KNApSAcK Metabolite C00045585
Metabolite
KNApSAcK Entry
| id | C00045585 |
|---|---|
| Name | 7,8-Oxido-isoxeniolide A / (+)-7,8-Oxido-isoxeniolide A |
| CAS RN | 71093-24-8 |
| Standard InChI | InChI=1S/C20H28O5/c1-12-10-16(21)17-20(4,25-17)9-7-13-14(6-5-8-19(2,3)23)18(22)24-11-15(12)13/h5-6,8,13,15-17,21,23H,1,7,9-11H2,2-4H3/b8-5+,14-6-/t13-,15+,16-,17+,20+/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C20H28O5/c1-12-10-16(21)17-20(4,25-17)9-7-13-14(6-5-8-19(2,3)23)18(22)24-11-15(12)13/h5-6,8,13,15-17,21,23H,1,7,9-11H2,2-4H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 5353 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer | CHEMBL494605 |
KEGG
| By LinkDB |
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CTD
| By CAS RN |
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