CFam Chemical Families Database
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You are searching for "CFAMM00172855" in compound.

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CFAM Mol ID CFAMM00172855
Family CFFCD835 Cinitapride family
Superfamily CFSCD737 Cinitapride Superfamily
Class CFCCD524 Class 1337
External ID 53665916 External Source PubChem
PubChem CID 53665916 Functional Category Patent Compound
Molecule Name AGN-PC-09WTXD
IUPAC Name tert-butyl 4-[4-[[4-(2-ethoxy-2-oxoethoxy)-2-nitrophenyl]carbamoyl]phenyl]piperazine-1-carboxylate
Synonyms SureCN8662814;tert-butyl 4-[4-[[4-(2-ethoxy-2-oxoethoxy)-2-nitrophenyl]carbamoyl]phenyl]piperazine-1-carboxylate
InChi InChI=1S/C26H32N4O8/c1-5-36-23(31)17-37-20-10-11-21(22(16-20)30(34)35)27-24(32)18-6-8-19(9-7-18)28-12-14-29(15-13-28)25(33)38-26(2,3)4/h6-11,16H,5,12-15,17H2,1-4H3,(H,27,32)
Formula C26H32N4O8 Molecular Weight 528.55
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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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