CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00142228" in compound.

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CFAM Mol ID CFAMM00142228
Family CFFCD196 Endothelin-1 receptor Ligand Atrasentan Family
Superfamily CFSCD179 Endothelin-1 receptor Ligand Atrasentan Superfamily
Class CFCCD141 Class 954
External ID 54208423 External Source PubChem
PubChem CID 54208423 Functional Category Patent Compound
Molecule Name SureCN4996460
IUPAC Name (2S,3S,4S)-4-(1,3-benzodioxol-5-yl)-1-[2-(2,4-dimethylanilino)-2-oxoethyl]-2-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid
InChi InChI=1S/C29H30N2O6/c1-17-4-10-23(18(2)12-17)30-26(32)15-31-14-22(20-7-11-24-25(13-20)37-16-36-24)27(29(33)34)28(31)19-5-8-21(35-3)9-6-19/h4-13,22,27-28H,14-16H2,1-3H3,(H,30,32)(H,33,34)/t22-,27+,28-/m1/s1
Formula C29H30N2O6 Molecular Weight 502.56
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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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National University of Singapore, Singapore

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