| BioID | bio288 |
|---|
| Name | AZUMAMIDE C |
|---|
| ChEMBL ID | CHEMBL257972 |
|---|
| Molecular Formula | C27H38N4O7 |
|---|
| Molecular Weight | 530.62 |
|---|
| Molecular Weight (Monoisotopic) | 530.274 |
|---|
| Type | Small molecule |
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| Max Phase | -- |
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| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | azumamide C |
|---|
| Smiles | CC(C)[C@H]1NC(=O)[C@@H](C)[C@@H](C/C=C\CCC(=O)O)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@@H](C)NC1=O |
|---|
| Inchi | InChI=1S/C27H38N4O7/c1-15(2)23-27(38)28-17(4)25(36)30-21(14-18-10-12-19(32)13-11-18)26(37)29-20(16(3)24(35)31-23)8-6-5-7-9-22(33)34/h5-6,10-13,15-17,20-21,23,32H,7-9,14H2,1-4H3,(H,28,38)(H,29,37)(H,30,36)(H,31,35)(H,33,34)/b6-5-/t16-,17+,20+,21+,23+/m0/s1 |
|---|
| Inchi Key | QKNOLJBQLJGNKI-LFUPQXEOSA-N |
|---|
| Molecular Species | ACID |
|---|
| Targets | 14.0 |
|---|
| Bioactivities | 24.0 |
|---|
| Np Likeness Score | 1.78 |
|---|
| Records Key | ['3, azumamide C', '6, AzuC', '5c', '7, azuC'] |
|---|
| Records Name | ['(Z)-6-[(2R,5R,8R,11R,12S)-8-(4-Hydroxy-benzyl)-2-isopropyl-5,12-dimethyl-3,6,9,13-tetraoxo-1,4,7,10tetraaza-cyclotridec-11-yl]-hex-4-enoic acid', 'azumamide C', 'azumamide C', 'Azumamide C'] |
|---|
| Withdrawn Flag | False |
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| Orphan | -1 |
|---|
