KNApSAcK Metabolite C00036510
Metabolite
KNApSAcK Entry
| id | C00036510 |
|---|---|
| Name | 3,12-Diacetyl-8-benzoylingol / (-)-3,12-Diacetyl-8-benzoylingol |
| CAS RN | 124657-64-3 |
| Standard InChI | InChI=1S/C31H38O9/c1-15-13-31-27(38-19(5)33)16(2)14-30(31,40-31)26(35)17(3)24(37-18(4)32)21-22(29(21,6)7)25(23(15)34)39-28(36)20-11-9-8-10-12-20/h8-13,16-17,21-25,27,34H,14H2,1-7H3/b15-13-/t16-,17+,21-,22+,23+,24-,25-,27-,30-,31?/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C31H38O9/c1-15-13-31-27(38-19(5)33)16(2)14-30(31,40-31)26(35)17(3)24(37-18(4)32)21-22(29(21,6)7)25(23(15)34)39-28(36)20-11-9-8-10-12-20/h8-13,16-17,21-25,27,34H,14H2,1-7H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 2613 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB |
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CTD
| By CAS RN |
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Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 1 |
Family
| family name | count |
|---|---|
| Euphorbiaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Euphorbia nivulia | 334690 | Euphorbiaceae | rosids | Viridiplantae |