KNApSAcK Metabolite C00003735
Metabolite
KNApSAcK Entry
| id | C00003735 |
|---|---|
| Name | Undulatone |
| CAS RN | 70993-77-0 |
| Standard InChI | InChI=1S/C27H34O11/c1-7-10(2)22(32)37-17-15-11(3)8-14(29)20(31)25(15,6)24-26-9-35-27(24,34)19(30)12(4)16(26)18(36-13(5)28)23(33)38-21(17)26/h7-8,12,15-21,24,30-31,34H,9H2,1-6H3/b10-7+/t12-,15-,16-,17-,18-,19-,20-,21-,24-,25-,26-,27+/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C27H34O11/c1-7-10(2)22(32)37-17-15-11(3)8-14(29)20(31)25(15,6)24-26-9-35-27(24,34)19(30)12(4)16(26)18(36-13(5)28)23(33)38-21(17)26/h7-8,12,15-21,24,30-31,34H,9H2,1-6H3 |
Cluster
| Phytochemical cluster | No. 51 |
|---|---|
| KCF-S cluster | No. 704 |
Link
ChEMBL
| By standard InChI | CHEMBL554759 |
|---|---|
| By standard InChI Main Layer | CHEMBL554759 CHEMBL2006033 |
KEGG
| By LinkDB | C08787 |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 1 |
Family
| family name | count |
|---|---|
| Simaroubaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Hannoa undulata | 459127 | Simaroubaceae | rosids | Viridiplantae |