KNApSAcK Metabolite C00032209
Metabolite
KNApSAcK Entry
| id | C00032209 |
|---|---|
| Name | Stigmasta-5,22-diene-3,7-diol / (3.beta.,7.beta.,22E)-Stigmasta-5,22-dien-3beta,7beta-diol |
| CAS RN | 64998-20-5 |
| Standard InChI | InChI=1S/C29H48O2/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-27-25(13-15-29(23,24)6)28(5)14-12-22(30)16-21(28)17-26(27)31/h8-9,17-20,22-27,30-31H,7,10-16H2,1-6H3/b9-8+/t19-,20-,22+,23-,24+,25+,26+,27+,28+,29-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C29H48O2/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-27-25(13-15-29(23,24)6)28(5)14-12-22(30)16-21(28)17-26(27)31/h8-9,17-20,22-27,30-31H,7,10-16H2,1-6H3 |
Cluster
| Phytochemical cluster | No. 11 |
|---|---|
| KCF-S cluster | No. 53 |
Link
ChEMBL
| By standard InChI | CHEMBL455107 |
|---|---|
| By standard InChI Main Layer | CHEMBL455107 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
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Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 1 |
Family
| family name | count |
|---|---|
| Asteraceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Inula cappa | 313931 | Asteraceae | asterids | Viridiplantae |