|
|
You are searching for "CFAMM00033716" in compound. Total 1 results found.
Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.
CFAM Mol ID | CFAMM00033716 |
Family | CFFAD188 D(2) dopamine receptor Ligand Nemonapride Family |
Superfamily | CFSAD176 D(2) dopamine receptor Ligand Nemonapride Superfamily |
Class | CFCAD171 Class 171 |
External ID | CHEMBL370182 |
External Source | CHEMBL |
PubChem CID |
11686484 |
Functional Category |
Bioactive |
Molecule Name |
AGN-PC-00E4J6 |
IUPAC Name |
2-[4-[2-[[5-[2-[1-[2-(4-amino-5-chloro-2-methoxybenzoyl)oxyethyl]piperidin-4-yl]ethylamino]-5-oxopentanoyl]amino]ethyl]piperidin-1-yl]ethyl 4-amino-5-chloro-2-methoxybenzoate |
Synonyms |
CHEBI:431352;2-[4-[2-[[5-[2-[1-[2-(4-amino-5-chloro-2-methoxybenzoyl)oxyethyl]piperidin-4-yl]ethylamino]-5-oxopentanoyl]amino]ethyl]piperidin-1-yl]ethyl 4-amino-5-chloro-2-methoxybenzoate |
InChi |
InChI=1S/C39H56Cl2N6O8/c1-52-34-24-32(42)30(40)22-28(34)38(50)54-20-18-46-14-8-26(9-15-46)6-12-44-36(48)4-3-5-37(49)45-13-7-27-10-16-47(17-11-27)19-21-55-39(51)29-23-31(41)33(43)25-35(29)53-2/h22-27H,3-21,42-43H2,1-2H3,(H,44,48)(H,45,49) |
InChiKey |
WFWSNKCYLXYVKA-UHFFFAOYSA-N |
Formula | C39H56Cl2N6O8 |
Molecular Weight | 807.80 |
Cross Link | CHEMBL370182 |
Structure |
|
Statistics of CFAM Database |
CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes. |
How to cite our database |
C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering.
Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).
|
Last update by |
2014.08.29
|
48698 visits since 2014 .........
Dr.
Chen Yuzong
Deputy
Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore
All rights reserved.
|