KNApSAcK Metabolite C00000510
Metabolite
KNApSAcK Entry
| id | C00000510 |
|---|---|
| Name | Isoheterotropatrione |
| CAS RN | 71358-32-2 |
| Standard InChI | InChI=1S/C36H48O12/c1-12-14-21-18-32(41-4)23(17-24(21)34(43-6,44-7)29(32)38)16-22-19-33(42-5)30(39)35(45-8,46-9)26(22)27-31(33,15-13-2)20-25(40-3)28(37)36(27,47-10)48-11/h12-13,18-20,23-24,26-27H,1-2,14-17H2,3-11H3/t23-,24?,26?,27?,31?,32?,33?/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C36H48O12/c1-12-14-21-18-32(41-4)23(17-24(21)34(43-6,44-7)29(32)38)16-22-19-33(42-5)30(39)35(45-8,46-9)26(22)27-31(33,15-13-2)20-25(40-3)28(37)36(27,47-10)48-11/h12-13,18-20,23-24,26-27H,1-2,14-17H2,3-11H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 4488 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| Magnoliophyta | 1 |
Family
| family name | count |
|---|---|
| Aristolochiaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Heterotropa talai M | 16728 | Aristolochiaceae | Magnoliophyta | Viridiplantae |