CFam Chemical Families Database
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You are searching for "CFAMM00471068" in compound.

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CFAM Mol ID CFAMM00471068
Family CFFBM24689 Signal transducer and activator of transcription 3 inhibitor [4-[(E)-4-[[(2S)-1-[(1R,2S,5S)-2-[[(2R)-5-amino-5-oxopentan-2-yl]carbamoyl]-3-azabicyclo[3.1.0]hexan-3-yl]-4-methyl-1-oxopentan-2-yl]amino]-4-oxobut-2-en-2-yl]phenyl] dihydrogen phosphate family
Superfamily CFSBM6718 Signal transducer and activator of transcription 3 Binder Superfamily 2
Class CFCBM2088 Class 5138
External ID CHEMBL577143 External Source CHEMBL
PubChem CID 44474307 Functional Category Bioactive
Molecule Name [4-[(E)-3-[[(2S)-1-[(1R,2S,5S)-2-[(4-amino-4-oxobutyl)carbamoyl]-3-azabicyclo[3.1.0]hexan-3-yl]-4-methyl-1-oxopentan-2-yl]amino]-3-oxoprop-1-enyl]phenyl] dihydrogen phosphate
IUPAC Name [4-[(E)-3-[[(2S)-1-[(1R,2S,5S)-2-[(4-amino-4-oxobutyl)carbamoyl]-3-azabicyclo[3.1.0]hexan-3-yl]-4-methyl-1-oxopentan-2-yl]amino]-3-oxoprop-1-enyl]phenyl] dihydrogen phosphate
Synonyms CHEBI:673096
InChi InChI=1S/C25H35N4O8P/c1-15(2)12-20(28-22(31)10-7-16-5-8-18(9-6-16)37-38(34,35)36)25(33)29-14-17-13-19(17)23(29)24(32)27-11-3-4-21(26)30/h5-10,15,17,19-20,23H,3-4,11-14H2,1-2H3,(H2,26,30)(H,27,32)(H,28,31)(H2,34,35,36)/b10-7+/t17-,19-,20+,23+/m1/s1
Formula C25H35N4O8P Molecular Weight 550.54
Cross Link CHEMBL577143

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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