CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00151237" 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 CFAMM00151237
Family CFFCD328 Coagulation factor X Inhibitor Otamixaban Family
Superfamily CFSCD303 Coagulation factor X Inhibitor Otamixaban Superfamily
Class CFCAD78 Class 78
External ID 54501859 External Source PubChem
PubChem CID 54501859 Functional Category Patent Compound
Molecule Name
IUPAC Name methyl (2R)-2-[(3-ethanimidoylphenyl)methyl]-3-[[4-(1-oxidopyridin-1-ium-3-yl)benzoyl]amino]butanoate;methyl (2R)-2-[(3-ethanimidoylphenyl)methyl]-3-[(4-pyridin-4-ylbenzoyl)amino]butanoate
InChi InChI=1S/C26H27N3O4.C26H27N3O3/c1-17(27)22-7-4-6-19(14-22)15-24(26(31)33-3)18(2)28-25(30)21-11-9-20(10-12-21)23-8-5-13-29(32)16-23;1-17(27)23-6-4-5-19(15-23)16-24(26(31)32-3)18(2)29-25(30)22-9-7-20(8-10-22)21-11-13-28-14-12-21/h4-14,16,18,24,27H,15H2,1-3H3,(H,28,30);4-15,18,24,27H,16H2,1-3H3,(H,29,30)/t2*18?,24-/m11/s1
Formula C52H54N6O7 Molecular Weight 875.02
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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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