KNApSAcK Metabolite C00042051
Metabolite
KNApSAcK Entry
| id | C00042051 |
|---|---|
| Name | 13-Dehydroxybaccatin III |
| CAS RN | 155588-14-0 |
| Standard InChI | InChI=1S/C31H38O10/c1-16-12-13-31(37)26(40-27(36)19-10-8-7-9-11-19)24-29(6,20(34)14-21-30(24,15-38-21)41-18(3)33)25(35)23(39-17(2)32)22(16)28(31,4)5/h7-11,20-21,23-24,26,34,37H,12-15H2,1-6H3/t20-,21+,23+,24-,26-,29+,30-,31+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C31H38O10/c1-16-12-13-31(37)26(40-27(36)19-10-8-7-9-11-19)24-29(6,20(34)14-21-30(24,15-38-21)41-18(3)33)25(35)23(39-17(2)32)22(16)28(31,4)5/h7-11,20-21,23-24,26,34,37H,12-15H2,1-6H3 |
Cluster
| Phytochemical cluster | No. 49 |
|---|---|
| KCF-S cluster | No. 164 |
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 chinensis | 29808 | Taxaceae | Spermatophyta | Viridiplantae |