KNApSAcK Metabolite C00039802
Metabolite
KNApSAcK Entry
| id | C00039802 |
|---|---|
| Name | Murucoidin I / (-)-Murucoidin I |
| CAS RN | 882691-08-9 |
| Standard InChI | InChI=1S/C51H88O22/c1-9-11-17-20-30-21-18-15-13-12-14-16-19-22-33(52)68-32-23-31(25(4)62-47(32)72-43-39(58)36(55)28(7)65-50(43)67-30)69-51-45(70-46(61)24(3)10-2)44(73-49-41(60)38(57)35(54)27(6)64-49)42(29(8)66-51)71-48-40(59)37(56)34(53)26(5)63-48/h24-32,34-45,47-51,53-60H,9-23H2,1-8H3/t24-,25-,26-,27-,28+,29-,30-,31+,32+,34-,35-,36-,37+,38+,39-,40+,41+,42-,43+,44+,45+,47-,48-,49-,50-,51-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C51H88O22/c1-9-11-17-20-30-21-18-15-13-12-14-16-19-22-33(52)68-32-23-31(25(4)62-47(32)72-43-39(58)36(55)28(7)65-50(43)67-30)69-51-45(70-46(61)24(3)10-2)44(73-49-41(60)38(57)35(54)27(6)64-49)42(29(8)66-51)71-48-40(59)37(56)34(53)26(5)63-48/h24-32,34-45,47-51,53-60H,9-23H2,1-8H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 87 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 1 |
Family
| family name | count |
|---|---|
| Convolvulaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Ipomoea murucoides | 1393930 | Convolvulaceae | asterids | Viridiplantae |