KNApSAcK Metabolite C00035373
Metabolite
KNApSAcK Entry
| id | C00035373 |
|---|---|
| Name | Praecoxin B |
| CAS RN | 86154-09-8 |
| Standard InChI | InChI=1S/C34H26O22/c35-7-20-30(56-34(52)12-6-18(41)26(46)28(48)22(12)21-11(33(51)54-20)5-17(40)25(45)27(21)47)29(55-32(50)10-3-15(38)24(44)16(39)4-10)19(42)8-53-31(49)9-1-13(36)23(43)14(37)2-9/h1-7,19-20,29-30,36-48H,8H2 |
| Standard InChI (Main Layer) | InChI=1S/C34H26O22/c35-7-20-30(56-34(52)12-6-18(41)26(46)28(48)22(12)21-11(33(51)54-20)5-17(40)25(45)27(21)47)29(55-32(50)10-3-15(38)24(44)16(39)4-10)19(42)8-53-31(49)9-1-13(36)23(43)14(37)2-9/h1-7,19-20,29-30,36-48H,8H2 |
Cluster
| Phytochemical cluster | No. 81 |
|---|---|
| KCF-S cluster | No. 302 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 1 |
Family
| family name | count |
|---|---|
| Melastomataceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Tibouchina semidecandra | 596822 | Melastomataceae | rosids | Viridiplantae |