KNApSAcK Metabolite C00043996
Metabolite
KNApSAcK Entry
| id | C00043996 |
|---|---|
| Name | Uvaol 3-caffeate / (+)-Uvaol 3-caffeate |
| CAS RN | 667465-76-1 |
| Standard InChI | InChI=1S/C39H56O5/c1-24-14-19-39(23-40)21-20-37(6)27(34(39)25(24)2)10-12-31-36(5)17-16-32(35(3,4)30(36)15-18-38(31,37)7)44-33(43)13-9-26-8-11-28(41)29(42)22-26/h8-11,13,22,24-25,30-32,34,40-42H,12,14-21,23H2,1-7H3/b13-9+/t24-,25+,30+,31-,32+,34+,36+,37-,38-,39-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C39H56O5/c1-24-14-19-39(23-40)21-20-37(6)27(34(39)25(24)2)10-12-31-36(5)17-16-32(35(3,4)30(36)15-18-38(31,37)7)44-33(43)13-9-26-8-11-28(41)29(42)22-26/h8-11,13,22,24-25,30-32,34,40-42H,12,14-21,23H2,1-7H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 78 |
Link
ChEMBL
| By standard InChI | CHEMBL444208 |
|---|---|
| By standard InChI Main Layer | CHEMBL444208 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
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Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 1 |
Family
| family name | count |
|---|---|
| Celastraceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Maytenus ilicifolia | 1081520 | Celastraceae | rosids | Viridiplantae |