Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L3VJ6S
|
|||
| Ligand Name |
2-{4-[2-Acetylamino-3-(4-carboxymethoxy-3-hydroxy-phenyl)-propionylamino]-butoxy}-6-hydroxy-benzoic acid methyl ester
|
|||
| Synonyms |
CHEMBL341103; 2-{4-[2-ACETYLAMINO-3-(4-CARBOXYMETHOXY-3-HYDROXY-PHENYL)-PROPIONYLAMINO]-BUTOXY}-6-HYDROXY-BENZOIC ACID METHYL ESTER; 918657-87-1; Benzoic acid,2-[4-[[(2S)-2-(acetylamino)-3-[4-(carboxymethoxy)-3-hydroxyphenyl]-1-oxopropyl]amino]butoxy]-6-hydroxy-,methyl ester; 1qxk; Benzoic acid, 2-[4-[[(2S)-2-(acetylamino)-3-[4-(carboxymethoxy)-3-hydroxyphenyl]-1-oxopropyl]amino]butoxy]-6-hydroxy-, methyl ester; BDBM50308851; ZINC13587215; Q27454347; (S)-2-(4-(2-acetamido-3-(4-(3-hydroxy-2-(methoxycarbonyl)phenoxy)butylamino)-3-oxopropyl)-2-hydroxyphenoxy)acetic acid; 2-[4-[[(2S)-2-(Acetylamino)-3-[3-hydroxy-4-(2-oxo-2-hydroxyethoxy)phenyl]propionyl]amino]butoxy]-6-hydroxybenzoic acid methyl ester; 2-{4-[(S)-2-Acetylamino-3-(4-carboxymethoxy-3-hydroxy-phenyl)-propionylamino]-butoxy}-6-hydroxy-benzoic acid methyl ester
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL
|
||
| Formula |
C25H30N2O10
|
|||
| Canonical SMILES |
CC(=O)NC(CC1=CC(=C(C=C1)OCC(=O)O)O)C(=O)NCCCCOC2=CC=CC(=C2C(=O)OC)O
|
|||
| InChI |
1S/C25H30N2O10/c1-15(28)27-17(12-16-8-9-20(19(30)13-16)37-14-22(31)32)24(33)26-10-3-4-11-36-21-7-5-6-18(29)23(21)25(34)35-2/h5-9,13,17,29-30H,3-4,10-12,14H2,1-2H3,(H,26,33)(H,27,28)(H,31,32)/t17-/m0/s1
|
|||
| InChIKey |
QEANZBIJPCAREV-KRWDZBQOSA-N
|
|||
| PubChem Compound ID | ||||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.