KNApSAcK Metabolite C00023793
Metabolite
KNApSAcK Entry
| id | C00023793 |
|---|---|
| Name | 3-Ketodehydrosulfurenic acid / (Isolated and identified as methyl-3-ketodehydrosulfurenate) |
| CAS RN | 38611-64-2 |
| Standard InChI | InChI=1S/C31H46O4/c1-18(2)19(3)9-10-20(27(34)35)23-17-26(33)31(8)22-11-12-24-28(4,5)25(32)14-15-29(24,6)21(22)13-16-30(23,31)7/h11,13,18,20,23-24,26,33H,3,9-10,12,14-17H2,1-2,4-8H3,(H,34,35)/t20-,23-,24+,26+,29-,30-,31-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C31H46O4/c1-18(2)19(3)9-10-20(27(34)35)23-17-26(33)31(8)22-11-12-24-28(4,5)25(32)14-15-29(24,6)21(22)13-16-30(23,31)7/h11,13,18,20,23-24,26,33H,3,9-10,12,14-17H2,1-2,4-8H3,(H,34,35) |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 551 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|
Family
| family name | count |
|---|---|
| Coriolaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Fomes officinalis | 40441 | Coriolaceae | Fungi |