CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00172876" 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 CFAMM00172876
Family CFFCD835 Cinitapride family
Superfamily CFSCD737 Cinitapride Superfamily
Class CFCCD524 Class 1337
External ID CHEMBL1802973 External Source CHEMBL
PubChem CID 53361218 Functional Category Bioactive
Molecule Name N-[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]-4-[7-[[(1R)-1-cyclohexylethyl]amino]-6-nitro-4-oxochromen-2-yl]benzamide
IUPAC Name N-[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]-4-[7-[[(1R)-1-cyclohexylethyl]amino]-6-nitro-4-oxochromen-2-yl]benzamide
InChi InChI=1S/C30H36N4O6/c1-17(2)13-24(29(31)36)33-30(37)21-11-9-20(10-12-21)27-16-26(35)22-14-25(34(38)39)23(15-28(22)40-27)32-18(3)19-7-5-4-6-8-19/h9-12,14-19,24,32H,4-8,13H2,1-3H3,(H2,31,36)(H,33,37)/t18-,24+/m1/s1
Formula C30H36N4O6 Molecular Weight 548.63
Cross Link CHEMBL1802973

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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