KNApSAcK Metabolite C00040856
Metabolite
KNApSAcK Entry
| id | C00040856 |
|---|---|
| Name | 9-Dihydro-13-acetylbaccatin III |
| CAS RN | 142203-65-4 |
| Standard InChI | InChI=1S/C33H42O12/c1-16-21(42-17(2)34)14-33(40)28(44-29(39)20-11-9-8-10-12-20)26-31(7,22(37)13-23-32(26,15-41-23)45-19(4)36)27(38)25(43-18(3)35)24(16)30(33,5)6/h8-12,21-23,25-28,37-38,40H,13-15H2,1-7H3/t21-,22-,23+,25+,26-,27-,28-,31+,32-,33+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C33H42O12/c1-16-21(42-17(2)34)14-33(40)28(44-29(39)20-11-9-8-10-12-20)26-31(7,22(37)13-23-32(26,15-41-23)45-19(4)36)27(38)25(43-18(3)35)24(16)30(33,5)6/h8-12,21-23,25-28,37-38,40H,13-15H2,1-7H3 |
Cluster
| Phytochemical cluster | No. 49 |
|---|---|
| KCF-S cluster | No. 164 |
Link
ChEMBL
| By standard InChI | CHEMBL75533 |
|---|---|
| By standard InChI Main Layer | CHEMBL75533 CHEMBL1731226 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN | C077498 |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| Spermatophyta | 3 |
Family
| family name | count |
|---|---|
| Taxaceae | 3 |
List (3)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Taxus brevifolia | 46220 | Taxaceae | Spermatophyta | Viridiplantae |
| Taxus canadensis | 88032 | Taxaceae | Spermatophyta | Viridiplantae |
| Taxus chinensis | 29808 | Taxaceae | Spermatophyta | Viridiplantae |
Human Protein / Gene in interaction
4 ChEMBL Protein in interactions
| accession | description | class description | compound | assay ID (# of activities) |
# of diseases
(OMIM / KEGG) |
|---|---|---|---|---|---|
| Q92830 | Histone acetyltransferase KAT2A | Enzyme | CHEMBL1731226 |
CHEMBL1738606
(1)
|
0 / 0 |
| O75496 | Geminin | Unclassified protein | CHEMBL1731226 |
CHEMBL2114843
(1)
CHEMBL2114780
(1)
|
0 / 0 |
| Q9HC16 | DNA dC->dU-editing enzyme APOBEC-3G | Enzyme | CHEMBL1731226 |
CHEMBL1963863
(1)
|
0 / 0 |
| O75874 | Isocitrate dehydrogenase [NADP] cytoplasmic | Enzyme | CHEMBL1731226 |
CHEMBL2354311
(1)
|
1 / 0 |