KNApSAcK Metabolite C00016534
Metabolite
KNApSAcK Entry
| id | C00016534 |
|---|---|
| Name | Aureobasidin T1 |
| CAS RN | 158412-72-7 |
| Standard InChI | InChI=1S/C60H92N8O11/c1-17-38(9)46-57(75)65(14)47(36(5)6)52(70)61-42(32-35(3)4)55(73)67(16)50(60(11,12)78)59(77)79-49(39(10)18-2)58(76)66(15)48(37(7)8)53(71)62-43(33-40-26-21-19-22-27-40)54(72)64(13)45(34-41-28-23-20-24-29-41)56(74)68-31-25-30-44(68)51(69)63-46/h19-24,26-29,35-39,42-50,78H,17-18,25,30-34H2,1-16H3,(H,61,70)(H,62,71)(H,63,69)/t38-,39+,42+,43+,44+,45+,46+,47+,48+,49-,50-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C60H92N8O11/c1-17-38(9)46-57(75)65(14)47(36(5)6)52(70)61-42(32-35(3)4)55(73)67(16)50(60(11,12)78)59(77)79-49(39(10)18-2)58(76)66(15)48(37(7)8)53(71)62-43(33-40-26-21-19-22-27-40)54(72)64(13)45(34-41-28-23-20-24-29-41)56(74)68-31-25-30-44(68)51(69)63-46/h19-24,26-29,35-39,42-50,78H,17-18,25,30-34H2,1-16H3,(H,61,70)(H,62,71)(H,63,69) |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 183 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer | CHEMBL1790680 CHEMBL1790681 CHEMBL1790689 CHEMBL1790693 CHEMBL1790694 CHEMBL1790695 CHEMBL1793802 CHEMBL2218862 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|
Family
| family name | count |
|---|---|
| Dothioraceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Aureobasidium pullulans R106 | 5579 | Dothioraceae | Fungi |
Human Protein / Gene in interaction
1 ChEMBL Protein in interactions
| accession | description | class description | compound | assay ID (# of activities) |
# of diseases
(OMIM / KEGG) |
|---|---|---|---|---|---|
| P08183 | Multidrug resistance protein 1 | drug | CHEMBL1790680 CHEMBL1790681 CHEMBL1790689 CHEMBL1790693 CHEMBL1790694 CHEMBL1790695 CHEMBL1793802 |
CHEMBL710067
(6)
CHEMBL710068
(6)
CHEMBL843940 (5) CHEMBL843941 (5) CHEMBL2075366 (1) |
1 / 0 |