CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00074114" 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 CFAMM00074114
Family CFFAD548 Synaptic vesicular amine transporter inhibitor indole alkaloid Reserpine Family
Superfamily CFSAD97 Tubulin, cyclic phosphodiesterase, amine transporter binding indole alkaloid Vindoline Tadalafil Reserpine Superfamily
Class CFCAD97 Class 97
External ID ZINC01322862 External Source ZINC
PubChem CID 1427452 Functional Category Natural Product
Molecule Name AC1LRSRU
IUPAC Name 2-methylpropyl 4-[[2-methoxy-5-[(1R)-6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-1-yl]phenyl]methoxy]benzoate
Synonyms ZINC01322862;2-methylpropyl 4-[[2-methoxy-5-[(1R)-6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-1-yl]phenyl]methoxy]benzoate
InChi InChI=1S/C31H34N2O5/c1-19(2)17-38-31(34)20-5-8-23(9-6-20)37-18-22-15-21(7-12-28(22)36-4)29-30-25(13-14-32-29)26-16-24(35-3)10-11-27(26)33-30/h5-12,15-16,19,29,32-33H,13-14,17-18H2,1-4H3/p+1/t29-/m1/s1
Formula C31H35N2O5+ Molecular Weight 515.62
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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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