CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00017300" in compound.

Total 1 results found.

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CFAM Mol ID CFAMM00017300
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 CHEMBL2371822 External Source CHEMBL
PubChem CID 73351705 Functional Category Bioactive
Molecule Name CHEMBL2371822
InChi InChI=1S/C80H95ClN18O16/c1-6-57(69(104)91-58(16-9-10-33-85-44(2)3)78(113)99-34-12-17-66(99)77(112)86-45(4)68(82)103)90-72(107)60(37-49-23-30-56(31-24-49)89-79(83)114)93-74(109)62(38-48-21-28-55(29-22-48)88-70(105)64-41-67(102)98-80(115)97-64)95-76(111)65(43-100)96-75(110)63(40-51-13-11-32-84-42-51)94-73(108)61(36-47-19-26-54(81)27-20-47)92-71(106)59(87-46(5)101)39-50-18-25-52-14-7-8-15-53(52)35-50/h1,7-8,11,13-15,18-32,35,42,44-45,57-66,85,100H,9-10,12,16-17,33-34,36-41,43H2,2-5H3,(H2,82,103)(H,86,112)(H,87,101)(H,88,105)(H,90,107)(H,91,104)(H,92,106)(H,93,109)(H,94,108)(H,95,111)(H,96,110)(H3,83,89,114)(H2,97,98,102,115)/t45-,57+,58+,59-,60+,61-,62+,63+,64+,65+,66+/m1/s1
Formula C80H95ClN18O16 Molecular Weight 1600.17
Cross Link CHEMBL2371822

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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National University of Singapore, Singapore

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