CFam Chemical Families Database
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You are searching for "CFAMM00017416" in compound.

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CFAM Mol ID CFAMM00017416
Family CFFAD87 Gonadotropin-releasing hormone receptor Ligand decapeptide analog Cetrorelix Family
Superfamily CFSAD85 Gonadotropin-releasing hormone receptor Ligand Cetrorelix Superfamily
Class CFCAD85 Class 85
External ID CHEMBL409747 External Source CHEMBL
PubChem CID 44388107 Functional Category Bioactive
Molecule Name CHEMBL409747
Synonyms CHEBI:397936
InChi InChI=1S/C82H108N16O17S2/c1-47(2)86-42-53-27-25-52(26-28-53)40-64-78(110)98-70(48(3)100)81(113)94-63(39-50-19-9-5-10-20-50)76(108)88-59-23-11-6-16-36-85-69(102)34-33-61(74(106)93-65(77(109)92-64)41-54-43-87-58-22-13-12-21-56(54)58)90-75(107)62(38-49-17-7-4-8-18-49)91-72(104)60(24-14-15-35-83)89-80(112)67(96-71(103)57(84)37-51-29-31-55(101)32-30-51)45-116-117-46-68(82(114)115)97-79(111)66(44-99)95-73(59)105/h4-5,7-10,12-13,17-22,25-32,43,47-48,57,59-68,70,86-87,99-101H,6,11,14-16,23-24,33-42,44-46,83-84H2,1-3H3,(H,85,102)(H,88,108)(H,89,112)(H,90,107)(H,91,104)(H,92,109)(H,93,106)(H,94,113)(H,95,105)(H,96,103)(H,97,111)(H,98,110)(H,114,115)/t48-,57+,59+,60-,61-,62-,63+,64+,65+,66+,67-,68+,70-/m1/s1
Formula C82H108N16O17S2 Molecular Weight 1653.96
Cross Link CHEMBL409747

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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Professor in Department of Pharmacy
National University of Singapore, Singapore

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