KNApSAcK Metabolite C00011183
Metabolite
KNApSAcK Entry
| id | C00011183 |
|---|---|
| Name | Acacetin 7-O-[2'''-O-rhamnosyl-2''-O-glucosylglucoside / 7-[(O-6-Deoxy-alpha-L-mannopyranosyl-(1->2)-O-beta-D-glucopyranosyl-(1->2)-beta-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one |
| CAS RN | 188342-32-7 |
| Standard InChI | InChI=1S/C34H42O19/c1-12-23(39)26(42)29(45)32(47-12)52-31-28(44)25(41)21(11-36)51-34(31)53-30-27(43)24(40)20(10-35)50-33(30)48-15-7-16(37)22-17(38)9-18(49-19(22)8-15)13-3-5-14(46-2)6-4-13/h3-9,12,20-21,23-37,39-45H,10-11H2,1-2H3/t12?,20?,21?,23-,24+,25+,26?,27-,28-,29-,30?,31?,32-,33+,34-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C34H42O19/c1-12-23(39)26(42)29(45)32(47-12)52-31-28(44)25(41)21(11-36)51-34(31)53-30-27(43)24(40)20(10-35)50-33(30)48-15-7-16(37)22-17(38)9-18(49-19(22)8-15)13-3-5-14(46-2)6-4-13/h3-9,12,20-21,23-37,39-45H,10-11H2,1-2H3 |
Cluster
| Phytochemical cluster | No. 15 |
|---|---|
| KCF-S cluster | No. 5 |
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 |
|---|---|
| rosids | 1 |
Family
| family name | count |
|---|---|
| Nitrariaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Peganum harmala | 43879 | Nitrariaceae | rosids | Viridiplantae |