KNApSAcK Metabolite C00037837
Metabolite
KNApSAcK Entry
| id | C00037837 |
|---|---|
| Name | Spergulin A / (+)-Spergulin A |
| CAS RN | 403740-06-7 |
| Standard InChI | InChI=1S/C35H58O11S/c1-18(36)31(4)13-14-33(6)27(31)20(38)16-35(8)28(33)19(37)15-23-32(5)11-10-24(30(2,3)22(32)9-12-34(23,35)7)45-29-25(40)26(21(39)17-44-29)46-47(41,42)43/h19-29,37-40H,9-17H2,1-8H3,(H,41,42,43)/t19-,20+,21-,22+,23-,24+,25-,26+,27+,28-,29?,31+,32+,33+,34-,35-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C35H58O11S/c1-18(36)31(4)13-14-33(6)27(31)20(38)16-35(8)28(33)19(37)15-23-32(5)11-10-24(30(2,3)22(32)9-12-34(23,35)7)45-29-25(40)26(21(39)17-44-29)46-47(41,42)43/h19-29,37-40H,9-17H2,1-8H3,(H,41,42,43) |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 3806 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| eudicotyledons | 1 |
Family
| family name | count |
|---|---|
| Molluginaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Mollugo spergula | 3591 | Molluginaceae | eudicotyledons | Viridiplantae |