KNApSAcK Metabolite C00023043
Metabolite
KNApSAcK Entry
| id | C00023043 |
|---|---|
| Name | Eschscholtzxanthone / (3'S)-4',5'-Didehydro-3'-hydroxy-4,5'-retro-beta,beta-caroten-3-one |
| CAS RN | 3484-59-1 |
| Standard InChI | InChI=1S/C40H52O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-26,35,41H,27-28H2,1-10H3/b15-11+,16-12+,19-13+,20-14+,29-17+,30-18+,31-21+,32-22+,37-23-,38-24-/t35-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C40H52O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-26,35,41H,27-28H2,1-10H3 |
Cluster
| Phytochemical cluster | No. 59 |
|---|---|
| KCF-S cluster | No. 26 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
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Species
Summary
Plant class
| class name | count |
|---|---|
| Spermatophyta | 1 |
Family
| family name | count |
|---|---|
| Taxaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Taxus baccata | 25629 | Taxaceae | Spermatophyta | Viridiplantae |