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You are searching for "CFAMM00386553" 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 | CFAMM00386553 |
Family | CFFBM8244 Melanocortin receptor 4 and Melanocortin receptor 5 ligand AC1OCFVD family |
Superfamily | CFSBM4456 Melanocortin receptor 4 and Melanocortin receptor 5 Binder Superfamily 3 |
Class | CFCBM119 Class 3169 |
External ID | CHEMBL179836 |
External Source | CHEMBL |
PubChem CID |
6918780 |
Functional Category |
Bioactive |
Molecule Name |
AC1OCFVD |
IUPAC Name |
(3S)-N-[(2R)-3-(4-chlorophenyl)-1-[4-[2-[methylsulfonyl(propyl)amino]phenyl]piperazin-1-yl]-1-oxopropan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide |
Synonyms |
CHEBI:402454;LS-193656;(3S)-N-[(2R)-3-(4-chlorophenyl)-1-[4-[2-[methylsulfonyl(propyl)amino]phenyl]piperazin-1-yl]-1-oxopropan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide |
InChi |
InChI=1S/C33H40ClN5O4S/c1-3-16-39(44(2,42)43)31-11-7-6-10-30(31)37-17-19-38(20-18-37)33(41)29(21-24-12-14-27(34)15-13-24)36-32(40)28-22-25-8-4-5-9-26(25)23-35-28/h4-15,28-29,35H,3,16-23H2,1-2H3,(H,36,40)/t28-,29+/m0/s1 |
InChiKey |
XMTYQIRCWZBVAL-URLMMPGGSA-N |
Formula | C33H40ClN5O4S |
Molecular Weight | 638.22 |
Cross Link | CHEMBL179836 |
Structure |
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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).
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Last update by |
2014.08.29
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Chen Yuzong
Deputy
Director of Center for Computational Science and Engineering
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National University of Singapore, Singapore
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