KNApSAcK Metabolite C00013692
Metabolite
KNApSAcK Entry
| id | C00013692 |
|---|---|
| Name | 6-Hydroxyluteolin 7-[6''-(3-hydroxy-3-methylglutaryl)glucoside]-3-glucuronide / 5-[7-[[6-O-(4-Carboxy-3-hydroxy-3-methyl-1-oxobutyl)-beta-D-glucopyranosyl]oxy]-5,6-dihydroxy-4-oxo-4H-1-benzopyran-2-yl]-2-hydroxyphenyl beta-D-glucopyranosiduronic acid |
| CAS RN | 165460-14-0 |
| Standard InChI | InChI=1S/C33H36O22/c1-33(49,7-18(36)37)8-19(38)50-9-17-22(40)24(42)27(45)31(54-17)53-16-6-15-20(23(41)21(16)39)12(35)5-13(51-15)10-2-3-11(34)14(4-10)52-32-28(46)25(43)26(44)29(55-32)30(47)48/h2-6,17,22,24-29,31-32,34,39-46,49H,7-9H2,1H3,(H,36,37)(H,47,48)/t17?,22-,24+,25+,26+,27?,28?,29?,31-,32-,33?/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C33H36O22/c1-33(49,7-18(36)37)8-19(38)50-9-17-22(40)24(42)27(45)31(54-17)53-16-6-15-20(23(41)21(16)39)12(35)5-13(51-15)10-2-3-11(34)14(4-10)52-32-28(46)25(43)26(44)29(55-32)30(47)48/h2-6,17,22,24-29,31-32,34,39-46,49H,7-9H2,1H3,(H,36,37)(H,47,48) |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 1093 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB |
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CTD
| By CAS RN |
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Species
Summary
Plant class
| class name | count |
|---|---|
| Embryophyta | 1 |
Family
| family name | count |
|---|---|
| Frullaniaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Frullania cesatiana | 95763 | Frullaniaceae | Embryophyta | Viridiplantae |