CFam Chemical Families Database
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You are searching for "CFAMM00313996" in compound.

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CFAM Mol ID CFAMM00313996
Family CFFBM646 Substance-P receptor ligand tert-butyl (2S,3R,4S)-3-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-4-(4-fluorophenyl)-2-(hydroxymethyl)pyrrolidine-1-carboxylate family
Superfamily CFSBM386 Substance-P receptor ligand tert-butyl (2S,3R,4S)-3-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-4-(4-fluorophenyl)-2-(hydroxymethyl)pyrrolidine-1-carboxylate Superfamily
Class CFCBM152 Class 3202
External ID CHEMBL272469 External Source CHEMBL
PubChem CID 44456865 Functional Category Bioactive
Molecule Name (6S,7R,7aS)-7-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-6-(4-fluorophenyl)-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-3-one
IUPAC Name (6S,7R,7aS)-7-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-6-(4-fluorophenyl)-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-3-one
InChi InChI=1S/C22H18F7NO3/c1-11(13-6-14(21(24,25)26)8-15(7-13)22(27,28)29)33-19-17(12-2-4-16(23)5-3-12)9-30-18(19)10-32-20(30)31/h2-8,11,17-19H,9-10H2,1H3/t11-,17-,18+,19-/m1/s1
Formula C22H18F7NO3 Molecular Weight 477.37
Cross Link CHEMBL272469

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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