KNApSAcK Metabolite C00027810
Metabolite
KNApSAcK Entry
| id | C00027810 |
|---|---|
| Name | Aeruginosin 102-B |
| CAS RN | 173401-69-9 |
| Standard InChI | InChI=1S/C33H44N6O11S/c34-33(35)38-13-1-2-24(31(38)45)36-29(43)27-16-20-7-10-22(41)17-26(20)39(27)32(46)25(14-18-3-8-21(40)9-4-18)37-30(44)28(42)15-19-5-11-23(12-6-19)50-51(47,48)49/h3-6,8-9,11-12,20,22,24-28,31,40-42,45H,1-2,7,10,13-17H2,(H3,34,35)(H,36,43)(H,37,44)(H,47,48,49)/t20-,22+,24+,25+,26-,27-,28+,31?/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C33H44N6O11S/c34-33(35)38-13-1-2-24(31(38)45)36-29(43)27-16-20-7-10-22(41)17-26(20)39(27)32(46)25(14-18-3-8-21(40)9-4-18)37-30(44)28(42)15-19-5-11-23(12-6-19)50-51(47,48)49/h3-6,8-9,11-12,20,22,24-28,31,40-42,45H,1-2,7,10,13-17H2,(H3,34,35)(H,36,43)(H,37,44)(H,47,48,49) |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 3498 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer | CHEMBL424192 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|
Family
| family name | count |
|---|
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Microcystis viridis | 44822 | Bacteria |
Human Protein / Gene in interaction
3 ChEMBL Protein in interactions
| accession | description | class description | compound | assay ID (# of activities) |
# of diseases
(OMIM / KEGG) |
|---|---|---|---|---|---|
| P00747 | Plasminogen | S1A | CHEMBL424192 |
CHEMBL847111
(1)
|
1 / 2 |
| P00734 | Prothrombin | S1A | CHEMBL424192 |
CHEMBL809418
(1)
|
4 / 2 |
| P07477 | Trypsin-1 | S1A | CHEMBL424192 |
CHEMBL816972
(1)
|
1 / 1 |
Related Disease
Diseases related to proteins in ChEMBL interactions
OMIM (6)
| OMIM | preferred title | UniProt |
|---|---|---|
| #167800 | Pancreatitis, hereditary; pctt |
P07477
|
| #217090 | Plasminogen deficiency, type i |
P00747
|
| #614390 | Pregnancy loss, recurrent, susceptibility to, 2; rprgl2 |
P00734
|
| #613679 | Prothrombin deficiency, congenital |
P00734
|
| #601367 | Stroke, ischemic |
P00734
|
| #188050 | Thrombophilia due to thrombin defect; thph1 |
P00734
|