CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00407179" 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 CFAMM00407179
Family CFFBM11156 Histamine H3 receptor ligand SureCN5093846 family
Superfamily CFSBM5389 Histamine H3 receptor and Nitric oxide synthase, brain Binder Superfamily
Class CFCAD286 Class 286
External ID ZINC01320192 External Source ZINC
PubChem CID 1425547 Functional Category Natural Product
Molecule Name AC1LRP59
IUPAC Name [(1R)-1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-thiophen-2-ylmethanone
Synonyms ZINC01320192;[(1R)-1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-thiophen-2-ylmethanone
InChi InChI=1S/C29H35NO5S/c1-5-32-24-12-11-20(17-25(24)33-6-2)16-23-22-19-27(35-8-4)26(34-7-3)18-21(22)13-14-30(23)29(31)28-10-9-15-36-28/h9-12,15,17-19,23H,5-8,13-14,16H2,1-4H3/t23-/m1/s1
Formula C29H35NO5S Molecular Weight 509.66
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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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