KNApSAcK Metabolite C00042754
Metabolite
KNApSAcK Entry
| id | C00042754 |
|---|---|
| Name | murucin 3 / (-)-murucin 3 |
| CAS RN | 864182-51-4 |
| Standard InChI | InChI=1S/C62H108O25/c1-8-11-13-14-15-16-19-22-26-31-41(65)82-55-49(73)53(85-62-57(48(72)51(35(5)76-62)81-40(64)28-10-3)86-58-47(71)45(69)44(68)39(33-63)80-58)36(6)77-60(55)84-52-37(7)78-61-56(50(52)74)83-42(66)32-27-23-20-17-18-21-25-30-38(29-24-12-9-2)79-59-54(87-61)46(70)43(67)34(4)75-59/h34-39,43-63,67-74H,8-33H2,1-7H3/t34-,35+,36+,37+,38+,39-,43-,44-,45+,46+,47-,48-,49-,50-,51+,52+,53+,54-,55-,56-,57-,58+,59+,60+,61+,62+/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C62H108O25/c1-8-11-13-14-15-16-19-22-26-31-41(65)82-55-49(73)53(85-62-57(48(72)51(35(5)76-62)81-40(64)28-10-3)86-58-47(71)45(69)44(68)39(33-63)80-58)36(6)77-60(55)84-52-37(7)78-61-56(50(52)74)83-42(66)32-27-23-20-17-18-21-25-30-38(29-24-12-9-2)79-59-54(87-61)46(70)43(67)34(4)75-59/h34-39,43-63,67-74H,8-33H2,1-7H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 87 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer | CHEMBL486182 |
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 |