CFam Chemical Families Database
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You are searching for "CFAMM00048061" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00048061
Family CFFAD298 Parathyroid hormone/parathyroid hormone-related peptide receptor ligand peptide Teriparatide Family
Superfamily CFSAD20 Peptide hormone receptor bindng peptide Superfamily
Class CFCAD20 Class 20
External ID CHEMBL293351 External Source CHEMBL
PubChem CID 44300358 Functional Category Bioactive
Molecule Name tert-butyl N-[(2S)-1-[[(2S)-1-[[3-hydroxy-6-methyl-1-[[(2S)-4-methyl-1-oxo-1-(pyridin-4-ylmethylamino)pentan-2-yl]amino]-1-oxoheptan-4-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate
IUPAC Name tert-butyl N-[(2S)-1-[[(2S)-1-[[3-hydroxy-6-methyl-1-[[(2S)-4-methyl-1-oxo-1-(pyridin-4-ylmethylamino)pentan-2-yl]amino]-1-oxoheptan-4-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate
Synonyms CHEBI:189076
InChi InChI=1S/C40H58N8O7/c1-25(2)17-30(34(49)21-35(50)45-31(18-26(3)4)36(51)43-22-28-13-15-41-16-14-28)46-38(53)33(20-29-23-42-24-44-29)47-37(52)32(19-27-11-9-8-10-12-27)48-39(54)55-40(5,6)7/h8-16,23-26,30-34,49H,17-22H2,1-7H3,(H,42,44)(H,43,51)(H,45,50)(H,46,53)(H,47,52)(H,48,54)/t30?,31-,32-,33-,34?/m0/s1
InChiKey ULHWJFTZJZSPCG-OMUSJNLJSA-N
Formula C40H58N8O7 Molecular Weight 762.94
Cross Link CHEMBL293351
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
 

 

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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