KNApSAcK Metabolite C00041954
Metabolite
KNApSAcK Entry
| id | C00041954 |
|---|---|
| Name | Umbellacin B |
| CAS RN | 871483-33-9 |
| Standard InChI | InChI=1S/C23H36O7/c1-14(2)18(25)7-6-16(12-30-15(3)24)17-8-10-22(4)13-23(28,11-9-19(22)26)20(17)21(27)29-5/h6,17-20,25-26,28H,1,7-13H2,2-5H3/b16-6-/t17-,18?,19+,20+,22+,23-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C23H36O7/c1-14(2)18(25)7-6-16(12-30-15(3)24)17-8-10-22(4)13-23(28,11-9-19(22)26)20(17)21(27)29-5/h6,17-20,25-26,28H,1,7-13H2,2-5H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 3015 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer | CHEMBL480083 |
KEGG
| By LinkDB |
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CTD
| By CAS RN |
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